SpectraBase Spectrum ID |
SbUvLEVDCA |
Name |
2-Chloro-5-methylphenol, o-isopropyloxycarbonyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
228.055321976 u |
Formula |
C11H13ClO3 |
InChI |
InChI=1S/C11H13ClO3/c1-7(2)14-11(13)15-10-6-8(3)4-5-9(10)12/h4-7H,1-3H3 |
InChIKey |
UHGNGZDFKSVPOT-UHFFFAOYSA-N |
Molecular Weight |
228.675 g/mol |
SMILES |
C1(=CC=C(C=C1OC(OC(C)C)=O)C)Cl |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.904913 |