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5-Acetyl-2-[[2-(3,4-diethoxyphenyl)-1-oxoethyl]amino]-4-methyl-3-thiophenecarboxylic acid ethyl ester
SpectraBase Compound ID 5FBirrPEP7w
InChI InChI=1S/C22H27NO6S/c1-6-27-16-10-9-15(11-17(16)28-7-2)12-18(25)23-21-19(22(26)29-8-3)13(4)20(30-21)14(5)24/h9-11H,6-8,12H2,1-5H3,(H,23,25)
InChIKey SSGOMYVJSUZBDQ-UHFFFAOYSA-N
Mol Weight 433.52 g/mol
Molecular Formula C22H27NO6S
Exact Mass 433.155909 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BPU8LQgQ5JA
Name 3-thiophenecarboxylic acid, 5-acetyl-2-[[(3,4-diethoxyphenyl)acetyl]amino]-4-methyl-, ethyl 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 433.155908761 u
Formula C22H27NO6S
InChI InChI=1S/C22H27NO6S/c1-6-27-16-10-9-15(11-17(16)28-7-2)12-18(25)23-21-19(22(26)29-8-3)13(4)20(30-21)14(5)24/h9-11H,6-8,12H2,1-5H3,(H,23,25)
InChIKey SSGOMYVJSUZBDQ-UHFFFAOYSA-N
Molecular Weight 433.519 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_17852
Solvent DMSO-d6
Source Vendor ID: NMR/11251987; Lab Info: PNA; Lab Number: PNA-0000013