| SpectraBase Spectrum ID |
AVu0J628dR9 |
| Name |
4-Penten-1-ol, 2,3-diethyl-2,3-dimethyl-, (R*,S*)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
170.167065327 u |
| Formula |
C11H22O |
| InChI |
InChI=1S/C11H22O/c1-6-10(4,7-2)11(5,8-3)9-12/h6,12H,1,7-9H2,2-5H3/t10-,11+/m0/s1 |
| InChIKey |
FTQKXXRAUWHTKL-WDEREUQCSA-N |
| Molecular Weight |
170.296 g/mol |
| SMILES |
[C@@]([C@@](CO)(CC)C)(C=C)(CC)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.920411 |
