Essential Oil Summary
| CAS | Area | Smiles | Formula | MW | Classify |
|---|---|---|---|---|---|
| 000076-49-3 | O=C(O[C@@H]1[C@@]2(C)C(C)(C)[C@@H](C1)CC2)C | 8307790 | C12H20O2 | 196.146 | Alkene |
| 000078-70-6 | OC(C=C)(CC/C=C(\C)/C)C | 200538010 | C10H18O | 154.136 | Phenols |
| 000087-44-5 | C=C1[C@@H]2[C@H](C(C)(C)C2)CCC(C)=CCC1 | 173133748 | C15H24 | 204.188 | Ketones |
| 000098-55-5 | OC(C)(C)C1CC=C(C)CC1 | 154900327 | C10H18O | 154.136 | Phenols |
| 000099-85-4 | C(C)(C)C1=CCC(C)=CC1 | 50099698 | C10H16 | 136.125 | Terpene |
| 000105-87-3 | O=C(OC/C=C(/CC/C=C(\C)/C)\C)C | 6665526 | C12H20O2 | 196.146 | Alkenyl ester |
| 000106-25-2 | OC/C=C(\CC/C=C(\C)/C)/C | 5124622 | C10H18O | 154.136 | Phenols |
| 000106-26-3 | O=C/C=C(\CC/C=C(\C)/C)/C | 7218047 | C10H16O | 152.120 | Aldehydes |
| 000110-44-1 | O=C(O)/C=C/C=C/C | 9396991 | C6H8O2 | 112.052 | Ketene |
| 000123-35-3 | C(C=C)(=C)CC/C=C(\C)/C | 101214939 | C10H16 | 136.125 | Ketones |
| 000127-91-3 | C=C1C2C(C)(C)C(C2)CC1 | 522017632 | C10H16 | 136.125 | Ketones |
| 000141-12-8 | O=C(OC/C=C(\CC/C=C(\C)/C)/C)C | 4799806 | C12H20O2 | 196.146 | Alkenyl ester |
| 000459-80-3 | O=C(O)C=C(CC/C=C(\C)/C)C | 5571272 | C10H16O2 | 168.115 | Ketene |
| 000470-82-6 | CC1(C)OC2(C)CCC1CC2 | 1433927252 | C10H18O | 154.136 | Aldehyde |
| 000499-97-8 | C(=C)(C)C1CCC(=C)CC1 | 16832541 | C10H16 | 136.125 | Ketones |
| 000500-02-7 | O=C1C=CC(C(C)C)CC1 | 10936170 | C9H14O | 138.104 | Ketene |
| 000515-00-4 | OCC=1C2C(C)(C)C(C2)CC=1 | 5327079 | C10H16O | 152.120 | Phenols |
| 000515-13-9 | C(=C)(C)[C@H]1[C@@](C=C)(C)CC[C@@H](C(=C)C)C1 | 17429607 | C15H24 | 204.188 | Ketones |
| 000527-84-4 | C(C)(C)c1c(C)cccc1 | 93856350 | C10H14 | 134.110 | Aromatics |
| 000586-62-9 | C(\C)(/C)=C\1/CC=C(C)CC/1 | 30726759 | C10H16 | 136.125 | Ketones |
| 000639-99-6 | OC(C)(C)[C@H]1C[C@@H](C(=C)C)[C@@](C=C)(C)CC1 | 5752142 | C15H26O | 222.198 | Phenols |
| 000764-13-6 | C(=C\C=C(/C)\C)(\C)/C | 146550 | C8H14 | 110.110 | Conjugate diene |
| 001139-30-6 | C=C1[C@@H]2[C@H](C(C)(C)C2)CC[C@@]2(C)O[C@@H]2CC1 | 33408856 | C15H24O | 220.183 | Ketones |
| 001197-06-4 | O[C@H]1C(C)=CC[C@@H](C(=C)C)C1 | 3225829 | C10H16O | 152.120 | Phenols |
| 002867-05-2 | C(C)(C)C12C(C(C)=CC1)C2 | 29780280 | C10H16 | 136.125 | Ketones |
| 003338-55-4 | C(=C\C/C=C(\C)/C)(\C=C)/C | 28118856 | C10H16 | 136.125 | Conjugated alkene |
| 003387-41-5 | C(C)(C)C12C(C(=C)CC1)C2 | 283448777 | C10H16 | 136.125 | Ketones |
| 003779-61-1 | C(=C/C/C=C(\C)/C)(\C=C)/C | 28481604 | C10H16 | 136.125 | Conjugate diene |
| 005392-40-5 | O=CC=C(CC/C=C(\C)/C)C | 10884902 | C10H16O | 152.120 | Aldehydes |
| 007216-56-0 | C(\C=C\C=C(/C)\C)(=C\C)/C | 19675115 | C10H16 | 136.125 | Conjugated alkene |
| 007299-42-5 | OC(C)(C)C1CCC(=C)CC1 | 23988072 | C10H18O | 154.136 | Phenols |
| 007785-26-4 | CC1(C)[C@@H]2C(C)=CC[C@H]1C2 | 347745320 | C10H16 | 136.125 | Ketones |
| 010208-80-7 | C(C)(C)[C@H]1[C@H]2[C@@H](C(C)=CC1)CCC(C)=C2 | 5805858 | C15H24 | 204.188 | Ketones |
| 015537-55-0 | O[C@]1(C)[C@H]2[C@](C(C)C)(C2)CC1 | 12402229 | C10H18O | 154.136 | Alkene |
| 016728-99-7 | C(C)(C)C1C2C(C(C)CC1)=CCC(C)=C2 | 4535784 | C15H24 | 204.188 | Ketones |
| 016729-00-3 | C(C)(C)C1CCC(C=2CCC(=CC12)C)C | 3479014 | C15H24 | 204.188 | Conjugate diene |
| 017699-14-8 | C(C)(C)[C@H]1[C@@H]2[C@H]3C(C)=CC[C@@]23[C@H](C)CC1 | 6956140 | 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 | 5522444 | C15H24 | 204.188 | Ketones |
| 019431-79-9 | O[C@H]1C(=C)CC[C@H]2C(C)(C)C[C@@H]2C(=C)CC1 | 4356503 | C15H24O | 220.183 | Phenols |
| 019888-34-7 | C[C@]12O[C@@H]1CC/C(/C)=C/CC(C)(C)/C=C/C2 | 12297876 | C15H24O | 220.183 | Alkene ether |
| 020071-49-2 | C=C1[C@H]2[C@@](C)(CC[C@@H]3C(C)(C)[C@H]23)CCC1 | 4503321 | C15H24 | 204.188 | Ketones |
| 020126-76-5 | O[C@@]1(C(C)C)CC=C(C)CC1 | 217390037 | C10H18O | 154.136 | Phenols |
| 020307-84-0 | C(=C)(C)[C@@H]1[C@](C=C)(C)CCC(C(C)C)=C1 | 222867009 | C15H24 | 204.188 | Ketones |
| 021391-99-1 | C(C)(C)[C@H]1c2c(C(C)=CC1)ccc(C)c2 | 4270608 | C15H20 | 200.157 | Aromatic alkene |
| 021473-37-0 | O[C@@]1(C(C)C)C=C[C@@](O)(C)CC1 | 6460257 | Na | 170.131 | Na |
| 023986-74-5 | C(C)(C)[C@H]1/C=C/C(=C)CC/C=C(\C)/CC1 | 10300422 | C15H24 | 204.188 | Conjugate diene |
| 029803-82-5 | O[C@@]1(C)C=C[C@@H](C(C)C)CC1 | 7842222 | C10H18O | 154.136 | Phenols |
| 030021-74-0 | C(C)(C)[C@@H]1[C@@H]2[C@H](C(=C)CC1)CCC(C)=C2 | 7215054 | C15H24 | 204.188 | Ketones |
| 050277-34-4 | C(C)(C)C1c2c(C(=C)CC1)ccc(C)c2 | 4754538 | C15H20 | 200.157 | Aromatic alkene |
| 057709-95-2 | O=C(O[C@@H]1[C@]2(C)OC(C)(C)[C@H](C1)CC2)C | 10083886 | Na | 212.141 | Na |
| 072937-55-4 | C(C)(C)[C@@H]1c2c([C@H](C)CC1)ccc(C)c2 | 81600746 | C15H22 | 202.172 | Aromatics |
| 074742-35-1 | C(=C)[C@@H]1C(=C)[C@H](C)C[C@H](C=C)C1 | 5342193 | Na | 162.141 | Na |
| 093836-50-1 | CC(=O)OC(C)(C)C1CCC(=C)CC1 | 17857630 | Na | 196.146 | Na |
| 1000062-61-9 | CC1(C)/C=C\C/C(C)=C\C/C=C(C)\CC1 | 62605911 | C15H24 | 204.188 | Na |
| 1000108-60-0 | CC(CC1=NC(=CN=C1)CC(C)C)C | 11351299 | Na | 192.163 | Na |
| 1000186-25-4 | C12C34CCCCC3(C4C(C1)=O)CO2 | 5079771 | Na | 178.099 | Na |
| 1000360-33-0 | CC1=CCC2C3C1C2(CCC3C(C)C)C | 27302238 | C15H24 | 204.188 | Na |
| 157477-72-0 | CC([C@@H]1CC[C@H](C)[C@@]2([H])CCC(C=C12)=C)C | 8109578 | C15H24 | 204.188 | Conjugate diene |
| 267665-20-3 | C(C)(C)[C@@H]1CC[C@@H]([C@@H]2CC=C(C=C12)C)C | 2668678 | C15H24 | 204.188 | Conjugate diene |