| SpectraBase Spectrum ID |
5lDXQawFbBx |
| Name |
4-Hexen-1-ol, 6-(2,6,6-trimethyl-1-cyclohexenyl)-4-methyl-, (E)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
236.214015521 u |
| Formula |
C16H28O |
| InChI |
InChI=1S/C16H28O/c1-13(7-6-12-17)9-10-15-14(2)8-5-11-16(15,3)4/h9,17H,5-8,10-12H2,1-4H3/b13-9+ |
| InChIKey |
RDYSZUCEVQRYDZ-UKTHLTGXSA-N |
| Molecular Weight |
236.399 g/mol |
| SMILES |
C1(=C(C(CCC1)(C)C)C\C=C\(CCCO)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.940888 |
