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3-thiophenecarboxylic acid, 5-acetyl-2-[[(3-bromophenoxy)acetyl]amino]-4-methyl-, ethyl ester
SpectraBase Compound ID LXQLDfDIlFo
InChI InChI=1S/C18H18BrNO5S/c1-4-24-18(23)15-10(2)16(11(3)21)26-17(15)20-14(22)9-25-13-7-5-6-12(19)8-13/h5-8H,4,9H2,1-3H3,(H,20,22)
InChIKey GJKSILRYODADLY-UHFFFAOYSA-N
Mol Weight 440.31 g/mol
Molecular Formula C18H18BrNO5S
Exact Mass 439.008907 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID J0jdxfEqt86
Name 3-thiophenecarboxylic acid, 5-acetyl-2-[[(3-bromophenoxy)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 439.008906853 u
Formula C18H18BrNO5S
InChI InChI=1S/C18H18BrNO5S/c1-4-24-18(23)15-10(2)16(11(3)21)26-17(15)20-14(22)9-25-13-7-5-6-12(19)8-13/h5-8H,4,9H2,1-3H3,(H,20,22)
InChIKey GJKSILRYODADLY-UHFFFAOYSA-N
Molecular Weight 440.308 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_13994
Solvent DMSO-d6
Source Vendor ID: ZI/10020768; Lab Info: PNA; Lab Number: PNA-1991135