| SpectraBase Spectrum ID |
8Z7W6r4AsMQ |
| Name |
Oxiranemethanol, .alpha.-(2,6,6-trimethyl-1-cyclohexen-1-yl)-, acetate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
238.156894565 u |
| Formula |
C14H22O3 |
| InChI |
InChI=1S/C14H22O3/c1-9-6-5-7-14(3,4)12(9)13(11-8-16-11)17-10(2)15/h11,13H,5-8H2,1-4H3 |
| InChIKey |
JRNCAOLMMXJQEW-UHFFFAOYSA-N |
| Molecular Weight |
238.327 g/mol |
| SMILES |
C1(C(C2OC2)OC(=O)C)=C(CCCC1(C)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.868578 |
