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benzo[b]thiophene-2-carboxylic acid, 3-amino-6-nitro-4-(2-propynyloxy)-, ethyl ester
SpectraBase Compound ID Jb9SQ0A5hcS
InChI InChI=1S/C14H12N2O5S/c1-3-5-21-9-6-8(16(18)19)7-10-11(9)12(15)13(22-10)14(17)20-4-2/h1,6-7H,4-5,15H2,2H3
InChIKey KYNBFJBQTRHXTA-UHFFFAOYSA-N
Mol Weight 320.32 g/mol
Molecular Formula C14H12N2O5S
Exact Mass 320.046693 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KOWDEY4Gqv3
Name benzo[b]thiophene-2-carboxylic acid, 3-amino-6-nitro-4-(2-propynyloxy)-, 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/C14H12N2O5S/c1-3-5-21-9-6-8(16(18)19)7-10-11(9)12(15)13(22-10)14(17)20-4-2/h1,6-7H,4-5,15H2,2H3
InChIKey KYNBFJBQTRHXTA-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_7913
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/10320340; Labnumber: DAL-01010018