SpectraBase Spectrum ID |
2o7a66UiVsc |
Name |
5-Chloro-2-methoxyphenylamine, N-ethoxycarbonyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
229.050570947 u |
Formula |
C10H12ClNO3 |
InChI |
InChI=1S/C10H12ClNO3/c1-3-15-10(13)12-8-6-7(11)4-5-9(8)14-2/h4-6H,3H2,1-2H3,(H,12,13) |
InChIKey |
CCOSBPRJSIJVIG-UHFFFAOYSA-N |
Molecular Weight |
229.663 g/mol |
SMILES |
C(OCC)(=O)NC1=CC(=CC=C1OC)Cl |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.965342 |