| SpectraBase Spectrum ID |
2jSk8wpVrbb |
| Name |
1-(4-Methoxyphenyl)-2-(1-hydroxycyclopropyl)ethanone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
206.094294308 u |
| Formula |
C12H14O3 |
| InChI |
InChI=1S/C12H14O3/c1-15-10-4-2-9(3-5-10)11(13)8-12(14)6-7-12/h2-5,14H,6-8H2,1H3 |
| InChIKey |
VFHVBXLUXUDGEB-UHFFFAOYSA-N |
| Molecular Weight |
206.241 g/mol |
| SMILES |
C1(CC(C2=CC=C(C=C2)OC)=O)(CC1)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.95726 |