Essential Oil Summary
| CAS | Area | Smiles | Formula | MW | Classify |
|---|---|---|---|---|---|
| 000110-54-3 | C(CCC)CC | 141527 | C6H14 | 86.110 | Na |
| 000126-33-0 | O=S1(=O)CCCC1 | 75833 | C4H8O2S | 120.025 | Na |
| 000471-84-1 | C=C1C2C(C)(C)C(C1)CC2 | 736122 | C10H16 | 136.125 | Na |
| 000473-13-2 | C(=C)(C)[C@H]1C[C@H]2C(C)=CCC[C@]2(C)CC1 | 1134567 | C15H24 | 204.188 | Na |
| 000473-15-4 | OC(C)(C)[C@H]1C[C@H]2C(=C)CCC[C@]2(C)CC1 | 1916532 | C15H26O | 222.198 | SesquiterpeneAlcohol |
| 000473-19-8 | CC1(C)C(C)C2CC1CC2 | 1099274 | C10H18 | 138.141 | Na |
| 000489-29-2 | CC1(C)[C@@H]2[C@H]1CC[C@@]1(C)C2=C(C)CCC1 | 1728669 | Na | 204.188 | Na |
| 000502-69-2 | O=C(CCCC(CCCC(CCCC(C)C)C)C)C | 1156773 | C18H36O | 268.277 | Aliphatics |
| 000629-94-7 | C(CCCCCCCCCC)CCCCCCCCCC | 1352244 | C21H44 | 296.344 | Aliphatic alkanes |
| 000630-01-3 | C(CCCCCCCCCCCCC)CCCCCCCCCCCC | 874106 | C26H54 | 366.423 | Na |
| 000630-06-8 | CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC | 687718 | C36H74 | 506.579 | Na |
| 000763-32-6 | OCCC(=C)C | 53397 | C5H10O | 86.073 | Na |
| 001139-30-6 | C=C1[C@@H]2[C@H](C(C)(C)C2)CC[C@@]2(C)O[C@@H]2CC1 | 7091456 | C15H24O | 220.183 | Ethers |
| 003691-11-0 | C(=C)(C)[C@H]1C[C@H]2[C@@H](C)CCC2=C(C)CC1 | 644574 | C15H24 | 204.188 | Na |
| 007763-71-5 | CC1NC1C1=CC=CC=C1 | 93887 | C9H11N | 133.089 | Na |
| 019431-80-2 | O[C@@H]1C(=C)CC[C@H]2C(C)(C)C[C@@H]2C(=C)CC1 | 2052550 | C15H24O | 220.183 | SesquiterpeneAlcohol |
| 021747-46-6 | C[C@H]1[C@H]2[C@@H]3C(C)(C)[C@@H]3CCC(C)=C2CC1 | 1927225 | C15H24 | 204.188 | Sesquiterpene |
| 055333-99-8 | C(CCCCCCCCCCCCC)(CCCCCC)CCCCCC | 1945433 | C26H54 | 366.423 | Aliphatic alkanes |
| 064723-50-8 | CC(C)C1=CC(=C(C=C1)C(CC)=O)N=O | 650710 | C12H15NO2 | 205.110 | Na |
| 071208-82-7 | C1CCC2(C(C1)O2)CS(=O)(=O)C3=CC=CC=C3 | 130767 | Na | 252.082 | Na |
| 073097-00-4 | O=C(OC)CCCC/C=C\C/C=C\C/C=C\C/C=C\CC | 475790 | C19H30O2 | 290.225 | Na |
| 073105-67-6 | ICC(CCCCCCCCC)C | 214793 | C12H25I | 296.100 | Na |
| 074685-57-7 | O=C1C2(CC3(C1)CC3)CC2 | 135981 | C9H12O | 136.089 | Na |
| 077026-88-1 | O(O)[C@@]1(C)C=C[C@H](C(=C)C)CC1 | 147808 | Na | 168.115 | Na |
| 088395-46-4 | O[C@]1(C)[C@H]2[C@@H]3C(C)(C)[C@@H]3CCC(C)=C2CC1 | 2584863 | C15H24O | 220.183 | SesquiterpeneAlcohol |
| 1000131-71-2 | C[C@]12CC[C@@H](/C(C)=C\C/C=C(C)\C)C[C@@]1([H])O2 | 855807 | C15H24O | 220.183 | Na |
| 1000157-89-1 | C=C1C(C1)CCCCCO | 90176 | Na | 140.120 | Na |
| 1000163-97-5 | CC1(C(CCCCC1)=C)O | 275097 | Na | 140.120 | Na |
| 1000191-85-4 | CC1(C2(OC2(CCC1O)C)C=CC(=C)C)C | 415111 | Na | 222.162 | Na |
| 1000211-11-2 | C=C1C2CCCCC2C1 | 2827758 | Na | 122.110 | Na |
| 1000309-12-6 | CCCCCCCCCCCCCCCOS(=O)OC(C)C | 48276 | Na | 334.254 | Na |
| 1000406-41-7 | C(CCCCCCCCCCCCC)OCCCCC | 311324 | Na | 284.308 | Na |
| 1000411-33-3 | CC=1C=CC(=C(C1)O)C1=NC(=NO1)C | 961967 | Na | 190.074 | Na |
| 405112-35-8 | CC1(C)C2C3C(C)CC=C3C(C)CCC12 | 809226 | Na | 204.188 | Na |
| 698365-10-5 | OC/C(=C\CC[C@@H](C)C1=CCC(C)=CC1)/C | 167007 | C15H24O | 220.183 | Na |
| 860473-40-1 | OCCC/C=C\C=C/C | 197658 | Na | 126.104 | Na |