SpectraBase Spectrum ID |
6vHinK3ChvQ |
Name |
1-(p-Methoxyphenyl)cyclohexanecarboxylic acid |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
234.125594437 u |
Formula |
C14H18O3 |
InChI |
InChI=1S/C14H18O3/c1-17-12-7-5-11(6-8-12)14(13(15)16)9-3-2-4-10-14/h5-8H,2-4,9-10H2,1H3,(H,15,16) |
InChIKey |
JKJAJSWMKTWWJS-UHFFFAOYSA-N |
Molecular Weight |
234.295 g/mol |
SMILES |
OC(C1(CCCCC1)C1=CC=C(C=C1)OC)=O |
Spectrum/Structure Validation Score (Raman) |
0.969714 |