Essential Oil Summary
| CAS | Area | Smiles | Formula | MW | Classify |
|---|---|---|---|---|---|
| 000078-70-6 | OC(C=C)(CC/C=C(\C)/C)C | 5021829 | C10H18O | 154.136 | Phenols |
| 000087-44-5 | C=C1[C@@H]2[C@H](C(C)(C)C2)CCC(C)=CCC1 | 177537133 | C15H24 | 204.188 | Ketones |
| 000098-55-5 | OC(C)(C)C1CC=C(C)CC1 | 3447041 | C10H18O | 154.136 | Phenols |
| 000099-85-4 | C(C)(C)C1=CCC(C)=CC1 | 5830326 | C10H16 | 136.125 | Terpene |
| 000123-35-3 | C(C=C)(=C)CC/C=C(\C)/C | 9395049 | C10H16 | 136.125 | Ketones |
| 000470-82-6 | CC1(C)OC2(C)CCC1CC2 | 9447810 | C10H18O | 154.136 | Aldehyde |
| 000473-13-2 | C(=C)(C)[C@H]1C[C@H]2C(C)=CCC[C@]2(C)CC1 | 319307549 | C15H24 | 204.188 | Ketones |
| 000483-78-3 | C(C)(C)c1c2c(c(C)cc1)ccc(C)c2 | 13934033 | C15H18 | 198.141 | Naphthalene ring |
| 000489-39-4 | C=C1[C@H]2[C@@H]([C@H](C)CC2)[C@@H]2C(C)(C)[C@@H]2CC1 | 118548772 | C15H24 | 204.188 | Ketones |
| 000489-40-7 | C[C@H]1[C@@H]2C(=C(C)CC2)[C@@H]2C(C)(C)[C@@H]2CC1 | 75374417 | C15H24 | 204.188 | Ketones |
| 000502-61-4 | C(=C/C/C=C(/CC/C=C(\C)/C)\C)(\C=C)/C | 65946271 | C15H24 | 204.188 | Conjugate diene |
| 000515-13-9 | C(=C)(C)[C@H]1[C@@](C=C)(C)CC[C@@H](C(=C)C)C1 | 70165887 | C15H24 | 204.188 | Ketones |
| 000527-84-4 | C(C)(C)c1c(C)cccc1 | 5794392 | C10H14 | 134.110 | Aromatics |
| 000562-74-3 | CC1=CCC(CC1)(O)C(C)C | 3365860 | C10H18O | 154.136 | Phenols |
| 000567-75-9 | O=C(CC(C)C)C1C(=O)C(C)(C)C(=O)C(C)(C)C1=O | 1099567646 | C15H22O4 | 266.152 | Alcohols |
| 000577-27-5 | O[C@]1(C)[C@H]2[C@H]([C@@H](C)CC2)[C@H]2C(C)(C)[C@H]2CC1 | 22267997 | C15H26O | 222.198 | Alkene |
| 000659-70-1 | O=C(OCCC(C)C)CC(C)C | 2947323 | C10H20O2 | 172.146 | Alkene |
| 001461-02-5 | C(CCCC(C)c1ccc(C)cc1)(C)C | 15497910 | C15H24 | 204.188 | Aromatics |
| 003856-25-5 | C(C)(C)[C@H]1[C@@H]2[C@H]3C(C)=CC[C@@H]2[C@@]3(C)CC1 | 112801733 | C15H24 | 204.188 | Ketones |
| 005009-05-2 | O=C(C(CC)C)C1C(=O)C(C)(C)C(=O)C(C)(C)C1=O | 389076993 | C15H22O4 | 266.152 | Alcohols |
| 005945-72-2 | O[C@]1(C)[C@H]2[C@@](C)(CC[C@@H](C(=C)C)C2)CCC1 | 42920055 | C15H26O | 222.198 | Na |
| 005989-27-5 | C(=C)(C)[C@H]1CC=C(C)CC1 | 5721346 | C10H16 | 136.125 | 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 | 46658860 | C15H24O | 220.183 | Phenols |
| 006753-98-6 | CC1(C)/C=C/C/C(/C)=C/CC/C(/C)=C/C1 | 19597753 | C15H24 | 204.188 | Ketones |
| 007785-70-8 | CC1(C)[C@H]2C(C)=CC[C@@H]1C2 | 33772670 | C10H16 | 136.125 | Ketones |
| 010208-80-7 | C(C)(C)[C@H]1[C@H]2[C@@H](C(C)=CC1)CCC(C)=C2 | 59340187 | C15H24 | 204.188 | Ketones |
| 014912-44-8 | C(C)(C)[C@H]1[C@H]2[C@@H]3C(C)=CC[C@H]2[C@]3(C)CC1 | 17860352 | C15H24 | 204.188 | Ketones |
| 016728-99-7 | C(C)(C)C1C2C(C(C)CC1)=CCC(C)=C2 | 357489531 | C15H24 | 204.188 | Ketones |
| 016729-00-3 | C(C)(C)C1CCC(C=2CCC(=CC12)C)C | 299061688 | C15H24 | 204.188 | Conjugate diene |
| 017066-67-0 | C(=C)(C)[C@H]1C[C@H]2C(=C)CCC[C@]2(C)CC1 | 294539108 | C15H24 | 204.188 | Ketones |
| 017334-55-3 | C[C@H]1[C@]2(C)[C@@H]3C(C)(C)[C@@H]3CCC2=CCC1 | 8754013 | C15H24 | 204.188 | Ketones |
| 017699-05-7 | C(=C\CCC1(C)C2C(C)=CCC1C2)(\C)/C | 17728053 | C15H24 | 204.188 | Ketones |
| 017699-14-8 | C(C)(C)[C@H]1[C@@H]2[C@H]3C(C)=CC[C@@]23[C@H](C)CC1 | 304906859 | C15H24 | 204.188 | Ketones |
| 018252-44-3 | C(C)(C)[C@H]1[C@@H]2[C@H]3C(=C)CC[C@@H]2[C@@]3(C)CC1 | 14605504 | C15H24 | 204.188 | Ketones |
| 020085-19-2 | C(C)(C)[C@@H]1[C@H]2[C@@H](C(C)=CC1)CCC(C)=C2 | 19470735 | C15H24 | 204.188 | Ketones |
| 022567-17-5 | C(=C)(C)[C@H]1C=C2[C@H](C)CC[C@@H]2[C@H](C)CC1 | 67920591 | C15H24 | 204.188 | Ketones |
| 022595-45-5 | O=C(C(C)C)C1C(=O)C(C)(C)C(=O)C(C)(C)C1=O | 404477424 | C14H20O4 | 252.136 | Alcohols |
| 030021-74-0 | C(C)(C)[C@@H]1[C@@H]2[C@H](C(=C)CC1)CCC(C)=C2 | 88582752 | C15H24 | 204.188 | Ketones |
| 036577-33-0 | C(C)(C)C1=C[C@@H]2[C@H](C)CC[C@@H]2C(C)=CC1 | 16903880 | C15H24 | 204.188 | Ketones |
| 039029-41-9 | C(C)(C)[C@@H]1[C@@H]2[C@@H](C(=C)CC1)CCC(C)=C2 | 53482814 | C15H24 | 204.188 | Ketones |
| 041519-18-0 | O=C(OCCC(C)C)/C(=C/C)/C | 5646641 | C10H18O2 | 170.131 | Alkenyl ester |
| 050277-34-4 | C(C)(C)C1c2c(C(=C)CC1)ccc(C)c2 | 15084005 | C15H20 | 200.157 | Aromatic alkene |
| 050861-53-5 | O=C(CCc1ccccc1)C1C(=O)C(C)(C)C(=O)C(C)(C)C1=O | 29426884 | C19H22O4 | 314.152 | Aromatic ketone |
| 055012-72-1 | Oc1c(C)ccc2C(C)CCC(C(C)C)c12 | 5527703 | Na | 218.167 | Na |
| 063180-33-6 | O=C1C=C2[C@@H](C(C)C)CC[C@@H](C)[C@@H]2CC1 | 11261048 | Na | 206.167 | Na |
| 065018-15-7 | OCC(=C)[C@H]1C[C@H]2C(C)=CCC[C@]2(C)CC1 | 9368937 | C15H24O | 220.183 | Phenols |
| 068832-35-9 | C=C1[C@H]2[C@H](C(C)(C)C2)CCC(C)=CCC1 | 50062585 | C15H24 | 204.188 | Ketones |
| 073209-42-4 | C(C)(C)[C@H]1c2c([C@H](C)CC1)ccc(C)c2 | 1227751544 | 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 | 11411823 | C15H24O | 220.183 | Ketones |
| 078204-62-3 | C=C1CCCC(C)(C)C2=CC(C)=CC=C21 | 43975157 | C15H20 | 200.157 | Aromatic alkene |
| 083783-86-2 | O=C(OC/C=C(\C)/C)/C(=C/C)/C | 3317324 | Na | 168.115 | Na |
| 084254-81-9 | O=C(OCCC(=C)C)C(CC)C | 11057716 | C10H18O2 | 170.131 | Alkenyl ester |
| 088728-58-9 | O[C@]1(C)[C@H]2[C@@H]([C@H](C)CC2)[C@@H]2C(C)(C)[C@@H]2CC1 | 5580530 | C15H26O | 222.198 | Alkene |
| 097232-74-1 | OC(C(=C)C)CC/C(=C/CC/C(=C/CC/C=C(/CC/C=C(/CC/C=C(\C)/C)\C)\C)/C)/C | 8706870 | C30H50O | 426.386 | Phenols |
| 1000131-99-4 | CC=1CC(CCC1C)C=O | 4412542 | Na | 138.104 | Na |
| 1000151-67-1 | CC1(C)C23C=CC(C3)C(C)(C)C2=CC=C1 | 6400208 | Na | 202.172 | Na |
| 1000156-12-5 | CC1CC=C2C1C3C(C3(C)C)CCC2=C | 6923971 | Na | 202.172 | Na |
| 1000159-38-6 | CC1=CC(C(CCC1)(C=C)C)C=C(C)C | 17658053 | C15H24 | 204.188 | Na |
| 1000360-33-0 | CC1=CCC2C3C1C2(CCC3C(C)C)C | 365735959 | C15H24 | 204.188 | Na |
| 1000373-73-2 | C/C(/C(=O)OCCC(=C)C)=C\C | 3695036 | Na | 168.115 | Na |
| 1000374-17-1 | C=C([C@@H]1CC=C2CCC[C@H](C)[C@@]2(C)C1)C | 5823867 | C15H24 | 204.188 | Na |
| 1000414-93-6 | Ic1cc(C=Nc2cc(C(c3oc(C)cc3)c3oc(C)cc3)ccc2)c(O)cc1 | 6745618 | C24H20INO3 | 204.188 | Na |
| 123123-37-5 | C(=C)(C)[C@@H]1C[C@H]2C(C)=CCC[C@]2(C)CC1 | 9076513 | C15H24 | 204.188 | Ketones |
| 124753-76-0 | O[C@@H]1C(=C)[C@H]2[C@@]3(C)[C@H]([C@@H]2[C@H](C(C)C)CC3)C1 | 30246842 | C15H24O | 220.183 | Phenols |
| 157477-72-0 | CC([C@@H]1CC[C@H](C)[C@@]2([H])CCC(C=C12)=C)C | 76769815 | C15H24 | 204.188 | Conjugate diene |
| 267665-20-3 | C(C)(C)[C@@H]1CC[C@@H]([C@@H]2CC=C(C=C12)C)C | 349054044 | C15H24 | 204.188 | Conjugate diene |