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Glycine, N-(3-chlorobenzoyl)-N-methyl-, ethyl ester

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Glycine, N-(3-chlorobenzoyl)-N-methyl-, ethyl ester
SpectraBase Compound ID 9TxAuo0nj13
InChI InChI=1S/C12H14ClNO3/c1-3-17-11(15)8-14(2)12(16)9-5-4-6-10(13)7-9/h4-7H,3,8H2,1-2H3
InChIKey GYSVNHDFKREJCX-UHFFFAOYSA-N
Mol Weight 255.7 g/mol
Molecular Formula C12H14ClNO3
Exact Mass 255.066221 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 2dRHLg1ITBu
Name Glycine, N-(3-chlorobenzoyl)-N-methyl-, ethyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 255.066221012 u
Formula C12H14ClNO3
InChI InChI=1S/C12H14ClNO3/c1-3-17-11(15)8-14(2)12(16)9-5-4-6-10(13)7-9/h4-7H,3,8H2,1-2H3
InChIKey GYSVNHDFKREJCX-UHFFFAOYSA-N
Molecular Weight 255.701 g/mol
SMILES C1(Cl)=CC(=CC=C1)C(=O)N(CC(=O)OCC)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.847809