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2-{[(5-phenyl-2H-tetraazol-2-yl)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid
SpectraBase Compound ID 3quuYrPNtge
InChI InChI=1S/C18H17N5O3S/c24-14(10-23-21-16(20-22-23)11-6-2-1-3-7-11)19-17-15(18(25)26)12-8-4-5-9-13(12)27-17/h1-3,6-7H,4-5,8-10H2,(H,19,24)(H,25,26)
InChIKey QOEUDZAOSPTPJI-UHFFFAOYSA-N
Mol Weight 383.43 g/mol
Molecular Formula C18H17N5O3S
Exact Mass 383.105211 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FUlwcTPBuji
Name 2-{[(5-phenyl-2H-tetraazol-2-yl)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid
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/C18H17N5O3S/c24-14(10-23-21-16(20-22-23)11-6-2-1-3-7-11)19-17-15(18(25)26)12-8-4-5-9-13(12)27-17/h1-3,6-7H,4-5,8-10H2,(H,19,24)(H,25,26)
InChIKey QOEUDZAOSPTPJI-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7000_6151
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/11242390; Labnumber: SAD-0003047; IOH_ID: IOH-006152