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methyl 5-(cyanosulfanyl)-2-{[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetyl]amino}benzoate
SpectraBase Compound ID 8QBEPbpdPu8
InChI InChI=1S/C19H13N3O5S/c1-27-19(26)14-8-11(28-10-20)6-7-15(14)21-16(23)9-22-17(24)12-4-2-3-5-13(12)18(22)25/h2-8H,9H2,1H3,(H,21,23)
InChIKey ZWFFESQARFTAAC-UHFFFAOYSA-N
Mol Weight 395.39 g/mol
Molecular Formula C19H13N3O5S
Exact Mass 395.057592 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2XLUnsDF64B
Name methyl 5-(cyanosulfanyl)-2-{[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetyl]amino}benzoate
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/C19H13N3O5S/c1-27-19(26)14-8-11(28-10-20)6-7-15(14)21-16(23)9-22-17(24)12-4-2-3-5-13(12)18(22)25/h2-8H,9H2,1H3,(H,21,23)
InChIKey ZWFFESQARFTAAC-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_7998
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: 128309; Labnumber: VGU-15445; VK_ID: VK-008002
Temperature 308 °C