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Methyl 4-(3-chloro-2-methylanilino)-4-oxobutanoate

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Methyl 4-(3-chloro-2-methylanilino)-4-oxobutanoate
SpectraBase Compound ID FPPR9UF5EYQ
InChI InChI=1S/C12H14ClNO3/c1-8-9(13)4-3-5-10(8)14-11(15)6-7-12(16)17-2/h3-5H,6-7H2,1-2H3,(H,14,15)
InChIKey BDHNYHOVLQBBOM-UHFFFAOYSA-N
Mol Weight 255.7 g/mol
Molecular Formula C12H14ClNO3
Exact Mass 255.066221 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FJ0VBYlh8cu
Name butanoic acid, 4-[(3-chloro-2-methylphenyl)amino]-4-oxo-, methyl ester
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C12H14ClNO3/c1-8-9(13)4-3-5-10(8)14-11(15)6-7-12(16)17-2/h3-5H,6-7H2,1-2H3,(H,14,15)
InChIKey BDHNYHOVLQBBOM-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_8516_3138
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: ZID/5038153; Labnumber: LP-CK-723; IOH_ID: IOH-010141