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o-Methoxycarbanilic acid, 2-chloroethyl ester

View entire compound with spectra: 3 NMR, 1 FTIR, and 1 Raman

o-Methoxycarbanilic acid, 2-chloroethyl ester
SpectraBase Compound ID GLUtRD4l9Bb
InChI InChI=1S/C10H12ClNO3/c1-14-9-5-3-2-4-8(9)12-10(13)15-7-6-11/h2-5H,6-7H2,1H3,(H,12,13)
InChIKey SCIHPKPHSBPEMB-UHFFFAOYSA-N
Mol Weight 229.66 g/mol
Molecular Formula C10H12ClNO3
Exact Mass 229.050571 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID DZB9pKCf5u1
Name o-Methoxycarbanilic acid, 2-chloroethyl ester
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/c1-14-9-5-3-2-4-8(9)12-10(13)15-7-6-11/h2-5H,6-7H2,1H3,(H,12,13)
InChIKey SCIHPKPHSBPEMB-UHFFFAOYSA-N
Molecular Weight 229.663 g/mol
SMILES N(C1=CC=CC=C1OC)C(OCCCl)=O
Spectrum/Structure Validation Score (Raman) 0.944643