| SpectraBase Spectrum ID |
7XhwUzCX5lK |
| Name |
1(2H)-Pentalenone, 2,2-bis(3-chloro-2-butenyl)hexahydro-5,5-dimethyl-, cis-(.+-.)- |
| CAS Registry Number |
129371-49-9 |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H26Cl2O |
| InChI |
InChI=1S/C18H26Cl2O/c1-12(19)5-7-18(8-6-13(2)20)10-14-9-17(3,4)11-15(14)16(18)21/h5-6,14-15H,7-11H2,1-4H3/b12-5-,13-6+/t14-,15-,18?/m1/s1 |
| InChIKey |
DKQXYOIIIJORHY-SBKIEWNGSA-N |
| Molecular Weight |
329.311 g/mol |
| SMILES |
C1(C([C@@]2(CC(C[C@@]2(C1)[H])(C)C)[H])=O)(C\C=C/(Cl)C)C\C=C\(Cl)C |
| SPLASH |
splash10-000i-0090000000-8a6e94c33e8d307bcee9 |
| Source of Spectrum |
F-46-1866-12 |
| Synonyms |
(3aR,6aR)-2-[(2E)-3-chloro-2-butenyl]-2-[(2Z)-3-chloro-2-butenyl]-5,5-dimethylhexahydro-1(2H)-pentalenone
3,3-Di(3-chloro-2-butenyl)-7,7-dimethylbicyclo[3.3.0]octan-2-one |
| Wiley ID |
1326285 |
