| SpectraBase Spectrum ID |
fbAtq0ZShC |
| Name |
(3Z,9Z)-7-Chloro-6-hydroxy-12-oxo-pentadeca-3,9-dien-1-yne |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H21ClO2 |
| InChI |
InChI=1S/C15H21ClO2/c1-3-5-6-12-15(18)14(16)11-8-7-10-13(17)9-4-2/h1,5-8,14-15,18H,4,9-12H2,2H3/b6-5-,8-7- |
| InChIKey |
MMIAGHOBPFCKGD-ISTTXYCBSA-N |
| Instrument Name |
Hewlett-Packard 5973 or thermo electron corporation DSQ |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np900298a |
| Molecular Weight |
268.784 g/mol |
| Optical Rotation |
[a]D20 = -9.5 (c = 0.20, CHCl3) |
| Reported Formula |
C15H21ClO2 |
| SMILES |
OC(C(C\C=C/CC(CCC)=O)Cl)C\C=C/C#C |
| SPLASH |
splash10-00di-5930000000-50c11814f0b23bf399e8 |
| Source of Spectrum |
G4-72-SM13-4 |
| Wiley ID |
1872278 |
