Essential Oil Summary
| CAS | Area | Smiles | Formula | MW | Classify |
|---|---|---|---|---|---|
| 000105-87-3 | O=C(OC/C=C(/CC/C=C(\C)/C)\C)C | 8999942 | C12H20O2 | 196.146 | Alkenyl ester |
| 000099-86-5 | C(C)(C)C1=CC=C(C)CC1 | 12495086 | C10H16 | 136.125 | Conjugate diene |
| 000099-87-6 | C(C)(C)c1ccc(C)cc1 | 32141524 | C10H14 | 134.110 | Aromatics |
| 000103-45-7 | O=C(OCCc1ccccc1)C | 16893619 | C10H12O2 | 164.084 | Aromatic ester |
| 005009-05-2 | O=C(C(CC)C)C1C(=O)C(C)(C)C(=O)C(C)(C)C1=O | 417576050 | C15H22O4 | 266.152 | Cyclopentanone |
| 000659-70-1 | O=C(OCCC(C)C)CC(C)C | 33581750 | C10H20O2 | 172.146 | Alkene |
| 000099-85-4 | C(C)(C)C1=CCC(C)=CC1 | 206439203 | C10H16 | 136.125 | Ketones |
| 004501-58-0 | O=CC[C@@H]1C(C)(C)C(C)=CC1 | 6990908 | C10H16O | 152.120 | Aldehydes |
| 000078-70-6 | OC(C=C)(CC/C=C(\C)/C)C | 10091319 | C10H18O | 154.136 | Phenols |
| 000079-92-5 | C=C1C(C)(C)C2CC1CC2 | 35619836 | C10H16 | 136.125 | Ketones |
| 001196-01-6 | O=C1[C@@H]2C(C)(C)[C@H](C(C)=C1)C2 | 801896547 | C10H14O | 150.104 | Ketene |
| 000547-61-5 | O[C@H]1C(=C)[C@@H]2C(C)(C)[C@H](C1)C2 | 157739055 | C10H16O | 152.120 | Phenols |
| 000552-02-3 | O[C@]1(C)[C@@H]2[C@@H]([C@H](C)CC2)[C@@H]2C(C)(C)[C@@H]2CC1 | 3458651 | C15H26O | 222.198 | Cycloalkanes |
| 000567-75-9 | O=C(CC(C)C)C1C(=O)C(C)(C)C(=O)C(C)(C)C1=O | 53343076 | C15H22O4 | 266.152 | Cyclopentanone |
| 005392-40-5 | O=CC=C(CC/C=C(\C)/C)C | 6039309 | C10H16O | 152.120 | Aldehydes |
| 005937-11-1 | O[C@]1(C)[C@H]2[C@H]([C@H](C(C)C)CC1)C=C(C)CC2 | 1455096779 | C15H26O | 222.198 | Phenols |
| 000105-91-9 | O=C(OC/C=C(\CC/C=C(\C)/C)/C)CC | 59912177 | C13H22O2 | 210.162 | Alkenyl ester |
| 000106-24-1 | OC/C=C(/CC/C=C(\C)/C)\C | 4343587 | C10H18O | 154.136 | Phenols |
| 000106-25-2 | OC/C=C(\CC/C=C(\C)/C)/C | 129365184 | C10H18O | 154.136 | Phenols |
| 000080-56-8 | CC1(C)C2C(C)=CCC1C2 | 6557863 | C10H16 | 136.125 | Ketones |
| 000087-44-5 | C=C1[C@@H]2[C@H](C(C)(C)C2)CCC(C)=CCC1 | 9836101 | C15H24 | 204.188 | Ketones |
| 000097-53-0 | O(C)c1c(O)ccc(CC=C)c1 | 10862772 | C10H12O2 | 164.084 | Aromatic ether |
| 000098-55-5 | OC(C)(C)C1CC=C(C)CC1 | 3588872 | C10H18O | 154.136 | Phenols |
| 000099-83-2 | C(C)(C)C1C=CC(C)=CC1 | 259826031 | C10H16 | 136.125 | Conjugate diene |
| 003779-61-1 | C(=C/C/C=C(\C)/C)(\C=C)/C | 134029315 | C10H16 | 136.125 | Conjugated triene |
| 003856-25-5 | C(C)(C)[C@H]1[C@@H]2[C@H]3C(C)=CC[C@@H]2[C@@]3(C)CC1 | 10563249 | C15H24 | 204.188 | Ketones |
| 095910-36-4 | C[C@H]1C=2[C@@H]3C(C)(C)[C@@H]3CC[C@@H](C)C=2CC1 | 33441283 | C15H24 | 204.188 | Ketones |
| 000577-27-5 | O[C@]1(C)[C@H]2[C@H]([C@@H](C)CC2)[C@H]2C(C)(C)[C@H]2CC1 | 10642829 | C15H26O | 222.198 | Alkene |
| 000586-62-9 | C(\C)(/C)=C\1/CC=C(C)CC/1 | 19531142 | C10H16 | 136.125 | Ketones |
| 041702-63-0 | C(C)(C)C1=C2[C@H]([C@H](C)CC1)CCC(C)=C2 | 65677121 | C15H24 | 204.188 | Conjugate diene |
| 054324-03-7 | C(C)(C)[C@H]1C=2[C@@H]([C@H](C)CC1)CCC(=C)C=2 | 137366997 | C15H24 | 204.188 | Conjugate diene |
| 001197-01-9 | OC(C)(C)c1ccc(C)cc1 | 7088515 | C10H14O | 150.104 | Aromatic alcohol |
| 001197-06-4 | O[C@H]1C(C)=CC[C@@H](C(=C)C)C1 | 13002857 | C10H16O | 152.120 | Phenols |
| 002867-05-2 | C(C)(C)C12C(C(C)=CC1)C2 | 11088929 | C10H16 | 136.125 | Ketones |
| 003338-55-4 | C(=C\C/C=C(\C)/C)(\C=C)/C | 17136990 | C10H16 | 136.125 | Conjugated alkene |
| 003479-89-8 | CC1(C)C=CC(C)=CC=C1 | 5289278 | C10H14 | 134.110 | Conjugated triene |
| 003691-11-0 | C(=C)(C)[C@H]1C[C@H]2[C@@H](C)CCC2=C(C)CC1 | 283764999 | C15H24 | 204.188 | Ketones |
| 000473-67-6 | OC1C=C(C)C2C(C)(C)C1C2 | 15445633 | C10H16O | 152.120 | Phenols |
| 000481-34-5 | O[C@@]1(C)[C@H]2[C@H]([C@H](C(C)C)CC1)C=C(C)CC2 | 18656979 | C15H26O | 222.198 | Ketones |
| 000483-77-2 | C(C)(C)[C@H]1c2c([C@@H](C)CC1)ccc(C)c2 | 550162097 | C15H22 | 202.172 | Aromatics |
| 095975-84-1 | OC12C(C)CCC3C(C)(C)C3C1C(C)CC2 | 12914796 | C15H26O | 222.198 | Cycloalkanes |
| 1000144-09-7 | C=C1CC[C@@H](C/C=C(C)\C)C(C)(C)[C@@H]1C=O | 14706930 | Na | 220.183 | Na |
| 1000149-94-6 | C12C=C(CCC1C2(C)C)C | 9028771 | C10H16 | 136.125 | Na |
| 1000151-67-1 | CC1(C)C23C=CC(C3)C(C)(C)C2=CC=C1 | 60294310 | Na | 202.172 | Na |
| 1000156-12-5 | CC1CC=C2C1C3C(C3(C)C)CCC2=C | 23351250 | C22H24N4OS | 202.172 | Na |
| 1000285-43-6 | CC(CC/C=C(CC/C=C(C)/C)\C)(O)C=C | 5436417 | Na | 222.198 | Na |
| 000123-35-3 | C(C=C)(=C)CC/C=C(\C)/C | 64111660 | C10H16 | 136.125 | Ketones |
| 000287-13-8 | C12C3CCCC2C31 | 45643 | C7H10 | 94.078 | Alkanes |
| 000470-82-6 | CC1(C)OC2(C)CCC1CC2 | 4872363 | C10H18O | 154.136 | Aldehyde |
| 000473-13-2 | C(=C)(C)[C@H]1C[C@H]2C(C)=CCC[C@]2(C)CC1 | 6456884 | C15H24 | 204.188 | Ketones |
| 000543-39-5 | OC(CCCC(C=C)=C)(C)C | 584637060 | C10H18O | 154.136 | Conjugate diene |
| 030021-74-0 | C(C)(C)[C@@H]1[C@@H]2[C@H](C(=C)CC1)CCC(C)=C2 | 29794339 | C15H24 | 204.188 | Ketones |
| 036262-09-6 | C(C)(C)C12C=CC(=C)C1C2 | 16526177 | C10H14 | 134.110 | Conjugate diene |
| 036577-33-0 | C(C)(C)C1=C[C@@H]2[C@H](C)CC[C@@H]2C(C)=CC1 | 67340207 | C15H24 | 204.188 | Ketones |
| 039029-41-9 | C(C)(C)[C@@H]1[C@@H]2[C@@H](C(=C)CC1)CCC(C)=C2 | 6042745 | C15H24 | 204.188 | Ketones |
| 040716-66-3 | OC(C=C)(CC/C=C(/CC/C=C(\C)/C)\C)C | 19710549 | C15H26O | 222.198 | Na |
| 000489-28-1 | CC1(C)[C@H]2[C@@H]3C(C)=CCC[C@@]3(C)CC[C@@H]12 | 10383911 | C15H24 | 204.188 | Ketones |
| 000489-29-2 | CC1(C)[C@@H]2[C@H]1CC[C@@]1(C)C2=C(C)CCC1 | 181595441 | Na | 204.188 | Na |
| 055012-72-1 | Oc1c(C)ccc2C(C)CCC(C(C)C)c12 | 27271826 | Na | 218.167 | Na |
| 056348-21-1 | C(=C\C1C2C(C)(C)C2C2C(C)(C)C12)(\C)/C | 4714905 | C15H24 | 204.188 | Ketones |
| 058543-96-7 | CC=1C(C2=CCCCC2)CCC=1 | 31264662 | Na | 162.141 | Na |
| 068832-35-9 | C=C1[C@H]2[C@H](C(C)(C)C2)CCC(C)=CCC1 | 9612507 | C15H24 | 204.188 | Ketones |
| 072747-25-2 | C=C1[C@H]2[C@@H]([C@H](C)CC2)[C@@H]2C(C)(C)[C@@H]2CC1 | 16962582 | Na | 204.188 | Na |
| 072937-55-4 | C(C)(C)[C@@H]1c2c([C@H](C)CC1)ccc(C)c2 | 27556312 | C15H22 | 202.172 | Aromatics |
| 073209-42-4 | C(C)(C)[C@H]1c2c([C@H](C)CC1)ccc(C)c2 | 4862306 | C15H22 | 202.172 | Aromatics |
| 077171-55-2 | O[C@@]1(C)[C@@H]2[C@H]3C(C)(C)[C@H]3CCC(=C)[C@H]2CC1 | 87196375 | C15H24O | 220.183 | Ketones |
| 078204-62-3 | C=C1CCCC(C)(C)C2=CC(C)=CC=C21 | 110243418 | Na | 200.157 | Aromatic alkenes |
| 016729-00-3 | C(C)(C)C1CCC(C=2CCC(=CC12)C)C | 65599164 | C15H24 | 204.188 | Conjugate diene |
| 000483-78-3 | C(C)(C)c1c2c(c(C)cc1)ccc(C)c2 | 38793362 | C15H18 | 198.141 | Naphthalene ring |
| 017066-67-0 | C(=C)(C)[C@H]1C[C@H]2C(=C)CCC[C@]2(C)CC1 | 95694772 | C15H24 | 204.188 | Ketones |
| 017334-55-3 | C[C@H]1[C@]2(C)[C@@H]3C(C)(C)[C@@H]3CCC2=CCC1 | 179545215 | C15H24 | 204.188 | Ketones |
| 006750-60-3 | O[C@@]([C@@]1([H])[C@@](C2(C)C)([H])[C@@]2([H])CC3)(C)CC[C@@]1([H])C3=C | 3917242 | Na | 220.183 | Na |
| 006753-98-6 | CC1(C)/C=C/C/C(/C)=C/CC/C(/C)=C/C1 | 413901785 | C15H24 | 204.188 | Ketones |
| 007212-44-4 | OC(C=C)(CCC=C(CC/C=C(\C)/C)C)C | 50267343 | C15H26O | 222.198 | Phenols |
| 007216-56-0 | C(\C=C\C=C(/C)\C)(=C\C)/C | 74337314 | C10H16 | 136.125 | Conjugated alkene |
| 010208-80-7 | C(C)(C)[C@H]1[C@H]2[C@@H](C(C)=CC1)CCC(C)=C2 | 46470363 | C15H24 | 204.188 | Ketones |
| 010361-39-4 | O=C(OCc1ccccc1)CCCC | 10855652 | C12H16O2 | 192.115 | Aromatic ester |
| 013062-00-5 | C(=C\CC/C(/C)=C/1\CC=C(C)CC\1)(\C)/C | 95402078 | C15H24 | 204.188 | Ketones |
| 013877-91-3 | C(=CC/C=C(\C)/C)(C=C)C | 7561411 | C10H16 | 136.125 | Conjugated alkene |
| 014912-44-8 | C(C)(C)[C@H]1[C@H]2[C@@H]3C(C)=CC[C@H]2[C@]3(C)CC1 | 3339906 | C15H24 | 204.188 | Ketones |
| 267665-20-3 | C(C)(C)[C@@H]1CC[C@@H]([C@@H]2CC=C(C=C12)C)C | 43061660 | C15H24 | 204.188 | Conjugate diene |
| 000489-40-7 | C[C@H]1[C@@H]2C(=C(C)CC2)[C@@H]2C(C)(C)[C@@H]2CC1 | 333464225 | C15H24 | 204.188 | Ketones |
| 000489-41-8 | O[C@@]1(C)[C@H]2[C@@H]([C@H](C)CC2)[C@@H]2C(C)(C)[C@@H]2CC1 | 123987098 | C15H26O | 222.198 | Alkene |
| 000514-95-4 | C=C1C(C)=CCCC1(C)C | C10H16 | 136.125 | Conjugate diene | |
| 000489-39-4 | C=C1[C@H]2[C@@H]([C@H](C)CC2)[C@@H]2C(C)(C)[C@@H]2CC1 | C15H24 | 204.188 | Ketones | |
| 000535-77-3 | C(C)(C)c1cc(C)ccc1 | C10H14 | 134.110 | Aromatics | |
| 029837-12-5 | C(C)(C)[C@H]1[C@H]2C([C@@H](C)CC1)=CCC(C)=C2 | C15H24 | 204.188 | Ketones | |
| 1000414-93-6 | Ic1cc(C=Nc2cc(C(c3oc(C)cc3)c3oc(C)cc3)ccc2)c(O)cc1 | C24H20INO3 | 204.188 | Na | |
| 000527-84-4 | C(C)(C)c1c(C)cccc1 | C10H14 | 134.110 | Aromatics | |
| 017699-14-8 | C(C)(C)[C@H]1[C@@H]2[C@H]3C(C)=CC[C@@]23[C@H](C)CC1 | C15H24 | 204.188 | Ketones | |
| 018172-67-3 | C=C1[C@H]2C(C)(C)[C@H](C2)CC1 | C10H16 | 136.125 | Ketones | |
| 020126-76-5 | O[C@@]1(C(C)C)CC=C(C)CC1 | C10H18O | 154.136 | Phenols | |
| 110823-68-2 | C(=C)(C)C1C(C=C)(C)CCC(C(=C)C)C1 | C15H24 | 204.188 | Ketones | |
| 1000360-33-0 | CC1=CCC2C3C1C2(CCC3C(C)C)C | C15H24 | 204.188 | Na | |
| 022567-17-5 | C(=C)(C)[C@H]1C=C2[C@H](C)CC[C@@H]2[C@H](C)CC1 | C15H24 | 204.188 | Ketones | |
| 1000374-19-9 | C=C([C@@H]1CCC(C)=C2CC[C@H](C)[C@]2([H])C1)C | Na | 204.188 | Na | |
| 021391-99-1 | C(C)(C)[C@H]1c2c(C(C)=CC1)ccc(C)c2 | Na | 200.157 | Aromatic alkenes | |
| 021747-46-6 | C[C@H]1[C@H]2[C@@H]3C(C)(C)[C@@H]3CCC(C)=C2CC1 | C15H24 | 204.188 | Ketones | |
| 025246-27-9 | C=C1[C@@H]2[C@@H]([C@H](C)CC2)[C@@H]2C(C)(C)[C@@H]2CC1 | C15H24 | 204.188 | Ketones |