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2,4-thiophenedicarboxylic acid, 5-[[(1,3-benzodioxol-5-yloxy)acetyl]amino]-3-methyl-, diethyl ester
SpectraBase Compound ID BsfB6EjF1Mh
InChI InChI=1S/C20H21NO8S/c1-4-25-19(23)16-11(3)17(20(24)26-5-2)30-18(16)21-15(22)9-27-12-6-7-13-14(8-12)29-10-28-13/h6-8H,4-5,9-10H2,1-3H3,(H,21,22)
InChIKey FWHGMHLZFJQLJE-UHFFFAOYSA-N
Mol Weight 435.45 g/mol
Molecular Formula C20H21NO8S
Exact Mass 435.098788 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BV0x5eC8ALw
Name 2,4-thiophenedicarboxylic acid, 5-[[(1,3-benzodioxol-5-yloxy)acetyl]amino]-3-methyl-, diethyl 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 435.098787806 u
Formula C20H21NO8S
InChI InChI=1S/C20H21NO8S/c1-4-25-19(23)16-11(3)17(20(24)26-5-2)30-18(16)21-15(22)9-27-12-6-7-13-14(8-12)29-10-28-13/h6-8H,4-5,9-10H2,1-3H3,(H,21,22)
InChIKey FWHGMHLZFJQLJE-UHFFFAOYSA-N
Molecular Weight 435.447 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_14007
Solvent DMSO-d6
Source Vendor ID: ZI/10024249; Lab Info: PNA; Lab Number: PNA-1991581