Essential Oil Summary
| CAS | Area | Smiles | Formula | MW | Classify |
|---|---|---|---|---|---|
| 000078-70-6 | OC(C=C)(CC/C=C(\C)/C)C | 12954363 | C10H18O | 154.136 | alkene |
| 000084-66-2 | O=C(OCC)c1c(C(=O)OCC)cccc1 | 166876243 | C12H14O4 | 222.089 | Esters |
| 000087-44-5 | C=C1[C@@H]2[C@H](C(C)(C)C2)CCC(C)=CCC1 | 130559605 | C15H24 | 204.188 | Hydrocarbons |
| 000089-81-6 | O=C1C(C(C)C)CCC(C)=C1 | 284311068 | C10H16O | 152.120 | alcohols |
| 000097-53-0 | O(C)c1c(O)ccc(CC=C)c1 | 6713247 | C10H12O2 | 164.084 | alkene |
| 000099-83-2 | C(C)(C)C1C=CC(C)=CC1 | 114646595 | C10H16 | 136.125 | Hydrocarbons |
| 000099-85-4 | C(C)(C)C1=CCC(C)=CC1 | 8706947 | C10H16 | 136.125 | Hydrocarbons |
| 000099-87-6 | C(C)(C)c1ccc(C)cc1 | 86318926 | C10H14 | 134.110 | Hydrocarbons |
| 000112-30-1 | OCCCCCCCCCC | 4558878 | C10H22O | 158.167 | alkene |
| 000123-35-3 | C(C=C)(=C)CC/C=C(\C)/C | 12874841 | C10H16 | 136.125 | Hydrocarbons |
| 000470-82-6 | CC1(C)OC2(C)CCC1CC2 | 270487981 | C10H18O | 154.136 | alcohols |
| 000483-76-1 | C(C)(C)[C@H]1[C@H]2C(=C(C)CC1)CCC(C)=C2 | 4644227 | C15H24 | 204.188 | Hydrocarbons |
| 000491-07-6 | O=C1[C@@H](C(C)C)CC[C@@H](C)C1 | 975371186 | C10H18O | 154.136 | alkene |
| 000514-95-4 | C=C1C(C)=CCCC1(C)C | 5312513 | C10H16 | 136.125 | Hydrocarbons |
| 000515-13-9 | C(=C)(C)[C@H]1[C@@](C=C)(C)CC[C@@H](C(=C)C)C1 | 10146323 | C15H24 | 204.188 | Hydrocarbons |
| 000546-79-2 | OC1(C)C2C(C(C)C)(C2)CC1 | 4056188 | C10H18O | 154.136 | Hydrocarbons |
| 000586-62-9 | C(\C)(/C)=C\1/CC=C(C)CC/1 | 21169874 | C10H16 | 136.125 | Hydrocarbons |
| 000589-98-0 | OC(CCCCC)CC | 26501241 | C8H18O | 130.136 | alkene |
| 000591-24-2 | O=C1CC(C)CCC1 | 10072873 | C7H12O | 112.089 | alcohols |
| 001139-30-6 | C=C1[C@@H]2[C@H](C(C)(C)C2)CC[C@@]2(C)O[C@@H]2CC1 | 19444943 | C15H24O | 220.183 | alkene |
| 001670-46-8 | O=C(C)C1C(=O)CCC1 | 7712800 | C7H10O2 | 126.068 | alcohols |
| 002216-51-5 | O[C@H]1[C@H](C(C)C)CC[C@@H](C)C1 | 32604558 | C10H20O | 156.151 | alkene |
| 002244-16-8 | O=C1C(C)=CC[C@H](C(=C)C)C1 | 4283183 | C10H14O | 150.104 | alcohols |
| 002778-68-9 | C[C@@H]1C[C@@H]2C(C)(C)[C@@H]2CC1 | 331257585 | C10H18O | 138.141 | Hydrocarbons |
| 002867-05-2 | C(C)(C)C12C(C(C)=CC1)C2 | 18597756 | C10H16 | 136.125 | Hydrocarbons |
| 003310-02-9 | OC1C(=C)C2C(C(C)C)(C1)C2 | 8576794 | Na | 152.120 | Na |
| 005208-59-3 | C(C)(C)[C@H]1[C@H]2[C@](C)([C@H]3[C@@H]2C(=C)CC3)CC1 | 3079636 | C15H24 | 204.188 | Hydrocarbons |
| 005989-27-5 | C(=C)(C)[C@H]1CC=C(C)CC1 | 188606561 | C10H16 | 136.125 | Hydrocarbons |
| 006750-60-3 | O[C@@]([C@@]1([H])[C@@](C2(C)C)([H])[C@@]2([H])CC3)(C)CC[C@@]1([H])C3=C | 5922317 | C15H24O | 220.183 | alkene |
| 006753-98-6 | CC1(C)/C=C/C/C(/C)=C/CC/C(/C)=C/C1 | 13283855 | C15H24 | 204.188 | Hydrocarbons |
| 007785-26-4 | CC1(C)[C@@H]2C(C)=CC[C@H]1C2 | 96223322 | C10H16 | 136.125 | Hydrocarbons |
| 014912-44-8 | C(C)(C)[C@H]1[C@H]2[C@@H]3C(C)=CC[C@H]2[C@]3(C)CC1 | 4941796 | C15H24 | 204.188 | Ketones |
| 015356-70-4 | OC1C(C(C)C)CCC(C)C1 | 1612960062 | C10H20O | 156.151 | alkene |
| 015932-80-6 | O=C1/C(=C(/C)\C)/CCC(C)C1 | 72615787 | C10H16O | 152.120 | alcohols |
| 017699-14-8 | C(C)(C)[C@H]1[C@@H]2[C@H]3C(C)=CC[C@@]23[C@H](C)CC1 | 5995193 | C15H24 | 204.188 | Ketones |
| 018172-67-3 | C=C1[C@H]2C(C)(C)[C@H](C2)CC1 | 111204721 | C10H16 | 136.125 | Hydrocarbons |
| 018968-23-5 | C[C@@H]1C[C@H]2C(C)(C)[C@H]2CC1 | 7752591 | Na | 138.141 | Na |
| 021290-09-5 | O[C@H]1[C@@H](C(=C)C)CC[C@@H](C)C1 | 50827807 | C10H18O | 154.136 | Na |
| 022428-87-1 | OC1CCC2(OCCO2)CC1 | 7996703 | C8H14O3 | 158.094 | alcohols |
| 023283-97-8 | O[C@@H]1[C@@H](C(C)C)CC[C@@H](C)C1 | 20024887 | C10H20O | 156.151 | alkene |
| 023986-74-5 | C(C)(C)[C@H]1/C=C/C(=C)CC/C=C(\C)/CC1 | 6875071 | C15H24 | 204.188 | Hydrocarbons |
| 025246-27-9 | C=C1[C@@H]2[C@@H]([C@H](C)CC2)[C@@H]2C(C)(C)[C@@H]2CC1 | 5445191 | C15H24 | 204.188 | Hydrocarbons |
| 035852-46-1 | O=C(OCC/C=C\CC)CCCC | 12901153 | C11H20O2 | 184.146 | Esters |
| 038049-04-6 | O=C1C(C)=C2[C@H](O1)C[C@H](C)CC2 | 9616397 | C10H14O2 | 166.099 | alcohols |
| 054253-56-4 | O=C(N(N=C)C(=O)[C@H]1NCCC1)[C@H]1NCCC1 | 3271148 | C7H16N2 | 128.131 | Lipid |
| 061141-99-9 | C(=CCC1C(C)(C)C1)C=C | 5293709 | Na | 136.125 | Na |
| 1000130-91-3 | CC\C=C/CCC#CCCCCCCCC | 3397956 | Na | 220.219 | Na |
| 1000360-33-0 | CC1=CCC2C3C1C2(CCC3C(C)C)C | 13821251 | Na | 204.188 | Na |
| 1000374-18-9 | CC([C@H](CC1)[C@@]2([H])[C@]([C@]1(C)[C@]32[H])([H])CCC3=C)C | 6822466 | Na | 204.188 | Na |
| 1000411-59-6 | CC1=CCC(C(C)(O)C)CC1 | 25478589 | Na | 154.136 | Na |
| 213969-56-3 | OC12C(=C(C(O1)=O)C)CC[C@H](C2)C | 5109742 | Na | 182.094 | Na |