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benzo[b]thiophene-3-carboxylic acid, 2-[[(3,4-dihydro-3-oxo-2H-1,4-benzothiazin-2-yl)acetyl]amino]-4,5,6,7-tetrahydro-, ethyl ester

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benzo[b]thiophene-3-carboxylic acid, 2-[[(3,4-dihydro-3-oxo-2H-1,4-benzothiazin-2-yl)acetyl]amino]-4,5,6,7-tetrahydro-, ethyl ester
SpectraBase Compound ID F06yaDiyB3f
InChI InChI=1S/C21H22N2O4S2/c1-2-27-21(26)18-12-7-3-5-9-14(12)29-20(18)23-17(24)11-16-19(25)22-13-8-4-6-10-15(13)28-16/h4,6,8,10,16H,2-3,5,7,9,11H2,1H3,(H,22,25)(H,23,24)
InChIKey SQGSBQLWMPEJMP-UHFFFAOYSA-N
Mol Weight 430.54 g/mol
Molecular Formula C21H22N2O4S2
Exact Mass 430.1021 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LBoKktIycvB
Name benzo[b]thiophene-3-carboxylic acid, 2-[[(3,4-dihydro-3-oxo-2H-1,4-benzothiazin-2-yl)acetyl]amino]-4,5,6,7-tetrahydro-, ethyl 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/C21H22N2O4S2/c1-2-27-21(26)18-12-7-3-5-9-14(12)29-20(18)23-17(24)11-16-19(25)22-13-8-4-6-10-15(13)28-16/h4,6,8,10,16H,2-3,5,7,9,11H2,1H3,(H,22,25)(H,23,24)
InChIKey SQGSBQLWMPEJMP-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_4359
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: NMR/11308938