| SpectraBase Spectrum ID |
BEApa419FDR |
| Name |
Oxiranemethanol, .alpha.-methyl-3-(2,2,6-trimethyl-7-oxabicyclo[4.1.0]hept-1-yl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
226.156894565 u |
| Formula |
C13H22O3 |
| InChI |
InChI=1S/C13H22O3/c1-8(14)9-10(15-9)13-11(2,3)6-5-7-12(13,4)16-13/h8-10,14H,5-7H2,1-4H3 |
| InChIKey |
GMNQQMOKDPFDFA-UHFFFAOYSA-N |
| Molecular Weight |
226.316 g/mol |
| SMILES |
C12(C3OC3C(O)C)C(CCCC1(C)C)(C)O2 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.906201 |
