| SpectraBase Spectrum ID |
68p9haiEqwH |
| Name |
(1Z,5E,8S,10R)-1,5-Dimethyl-8,10-di(prop-1-en-2-yl)cyclododeca-1,5-diene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
272.250401030 u |
| Formula |
C20H32 |
| InChI |
InChI=1S/C20H32/c1-15(2)19-12-10-17(5)8-7-9-18(6)11-13-20(14-19)16(3)4/h10-11,19-20H,1,3,7-9,12-14H2,2,4-6H3/b17-10-,18-11+/t19-,20+/m1/s1 |
| InChIKey |
FVAWWQKNZAPHAY-HEPMWFERSA-N |
| Molecular Weight |
272.476 g/mol |
| SMILES |
C1\C=C/(CCC\C(=C\C[C@@](C[C@@]1(C(C)=C)[H])(C(=C)C)[H])C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.973466 |
