| SpectraBase Spectrum ID |
I1hlNOJPlo6 |
| Name |
3-Cyclohexen-1-ol, 5-methylene-6-(1-methylethenyl)-, acetate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
192.115029753 u |
| Formula |
C12H16O2 |
| InChI |
InChI=1S/C12H16O2/c1-8(2)12-9(3)6-5-7-11(12)14-10(4)13/h5-6,11-12H,1,3,7H2,2,4H3 |
| InChIKey |
YJIDJJQLHFCUCZ-UHFFFAOYSA-N |
| Molecular Weight |
192.258 g/mol |
| SMILES |
CC(=C)C1C(OC(C)=O)CC=CC1=C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.929249 |
