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3-thiophenecarboxylic acid, 2-[[2-(2,4-dichlorophenoxy)-1-oxopropyl]amino]-4,5-dimethyl-, methyl ester
SpectraBase Compound ID DnlyP0rm23y
InChI InChI=1S/C17H17Cl2NO4S/c1-8-10(3)25-16(14(8)17(22)23-4)20-15(21)9(2)24-13-6-5-11(18)7-12(13)19/h5-7,9H,1-4H3,(H,20,21)
InChIKey QXMSRGXXOOWLSK-UHFFFAOYSA-N
Mol Weight 402.29 g/mol
Molecular Formula C17H17Cl2NO4S
Exact Mass 401.025535 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KxULQPw8oBT
Name 3-thiophenecarboxylic acid, 2-[[2-(2,4-dichlorophenoxy)-1-oxopropyl]amino]-4,5-dimethyl-, methyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 401.025534601 u
Formula C17H17Cl2NO4S
InChI InChI=1S/C17H17Cl2NO4S/c1-8-10(3)25-16(14(8)17(22)23-4)20-15(21)9(2)24-13-6-5-11(18)7-12(13)19/h5-7,9H,1-4H3,(H,20,21)
InChIKey QXMSRGXXOOWLSK-UHFFFAOYSA-N
Molecular Weight 402.292 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_12536
Solvent DMSO-d6
Source Vendor ID: ZI/10028000; Lab Info: PNA; Lab Number: PNA-1991947