| SpectraBase Spectrum ID |
IA5F6I1U3Xi |
| Name |
2-Acetyl-2-ethenylcyclohexan-1-ol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
168.115029753 u |
| Formula |
C10H16O2 |
| InChI |
InChI=1S/C10H16O2/c1-3-10(8(2)11)7-5-4-6-9(10)12/h3,9,12H,1,4-7H2,2H3/t9-,10-/m0/s1 |
| InChIKey |
WMORTUOIMFRVTC-UWVGGRQHSA-N |
| Molecular Weight |
168.236 g/mol |
| SMILES |
[C@]1(C(=O)C)(C=C)[C@@](O)(CCCC1)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.891874 |