| SpectraBase Spectrum ID |
5R8OuqvBoEJ |
| Name |
3-(alpha-Hydroxybenzhydryl)-1,2,2-trimethyl-1-cyclopentanecarboxylic acid |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
338.188194694 u |
| Formula |
C22H26O3 |
| InChI |
InChI=1S/C22H26O3/c1-20(2)18(14-15-21(20,3)19(23)24)22(25,16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-13,18,25H,14-15H2,1-3H3,(H,23,24) |
| InChIKey |
FHDLXPBOMVEMKM-UHFFFAOYSA-N |
| Molecular Weight |
338.447 g/mol |
| SMILES |
C1C(C(C)(C)C(C1)C(C1=CC=CC=C1)(O)C1=CC=CC=C1)(C)C(O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.937196 |
