SpectraBase Spectrum ID |
5EMTqthTuB4 |
Name |
4-(Cyclopent-2-en-1-yl)phenol, acetate |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
202.099379689 u |
Formula |
C13H14O2 |
InChI |
InChI=1S/C13H14O2/c1-10(14)15-13-8-6-12(7-9-13)11-4-2-3-5-11/h2,4,6-9,11H,3,5H2,1H3 |
InChIKey |
WFHKIESDJHEVMQ-UHFFFAOYSA-N |
Molecular Weight |
202.253 g/mol |
SMILES |
C1(OC(C)=O)=CC=C(C=C1)C1CCC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.892329 |