| SpectraBase Spectrum ID |
KOhRfGs0XoZ |
| Name |
2-(3-Methoxyphenyl)-7-oxabicyclo[3.3.0]oct-1-en-3-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
230.094294308 u |
| Formula |
C14H14O3 |
| InChI |
InChI=1S/C14H14O3/c1-16-11-4-2-3-9(5-11)14-12-8-17-7-10(12)6-13(14)15/h2-5,10H,6-8H2,1H3 |
| InChIKey |
ZHGBPLATMDHFAW-UHFFFAOYSA-N |
| Molecular Weight |
230.263 g/mol |
| SMILES |
C12=C(C(CC1COC2)=O)C=1C=C(C=CC1)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.851398 |
![2-(3-Methoxyphenyl)-7-oxabicyclo[3.3.0]oct-1-en-3-one](/api/spectrum/KOhRfGs0XoZ/structure.png?h=300&w=458 "2-(3-Methoxyphenyl)-7-oxabicyclo[3.3.0]oct-1-en-3-one")
