SpectraBase Spectrum ID |
6bFQ9jIX5Yf |
Name |
(1R,2S,3R,4S)-4-[(Z)-dec-1'-Enyl]-2-ethyl-3-ethenylcyclopentan-1-ol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
278.260965714 u |
Formula |
C19H34O |
InChI |
InChI=1S/C19H34O/c1-4-7-8-9-10-11-12-13-14-16-15-19(20)18(6-3)17(16)5-2/h5,13-14,16-20H,2,4,6-12,15H2,1,3H3/b14-13-/t16-,17-,18+,19-/m1/s1 |
InChIKey |
MUSRDJFTIGAROU-UIJXSHHKSA-N |
Molecular Weight |
278.480 g/mol |
SMILES |
[C@@]1([C@@](C[C@]([C@]1(CC)[H])(O)[H])(\C=C/CCCCCCCC)[H])(C=C)[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.904231 |