SpectraBase Spectrum ID |
2eT2xUzpRZg |
Name |
Cyclopropanecarboxylic acid, 1-chloro-2,2-diphenyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
272.060407357 u |
Formula |
C16H13ClO2 |
InChI |
InChI=1S/C16H13ClO2/c17-16(14(18)19)11-15(16,12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10H,11H2,(H,18,19) |
InChIKey |
UCRXSAVCQISJPZ-UHFFFAOYSA-N |
SMILES |
C1(C(C=2C=CC=CC2)(C=2C=CC=CC2)C1)(C(=O)O)Cl |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.956863 |