| SpectraBase Spectrum ID |
4Y45vKvfV1e |
| Name |
(E)-2,7-Dimethyl-3,6-di(propan-2-yl)-4-octene-3,6-diol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
256.240230268 u |
| Formula |
C16H32O2 |
| InChI |
InChI=1S/C16H32O2/c1-11(2)15(17,12(3)4)9-10-16(18,13(5)6)14(7)8/h9-14,17-18H,1-8H3/b10-9+ |
| InChIKey |
UCUXOMWHIYCHHS-MDZDMXLPSA-N |
| Molecular Weight |
256.430 g/mol |
| SMILES |
CC(C(\C=C\C(C(C)C)(O)C(C)C)(O)C(C)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.956376 |