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4H-cyclopenta[b]thiophene-3-carboxylic acid, 5,6-dihydro-2-[[[(1-phenyl-1H-tetrazol-5-yl)thio]acetyl]amino]-, methyl ester

View entire compound with spectra: 1 NMR

4H-cyclopenta[b]thiophene-3-carboxylic acid, 5,6-dihydro-2-[[[(1-phenyl-1H-tetrazol-5-yl)thio]acetyl]amino]-, methyl ester
SpectraBase Compound ID 72r2Yt9q6VY
InChI InChI=1S/C18H17N5O3S2/c1-26-17(25)15-12-8-5-9-13(12)28-16(15)19-14(24)10-27-18-20-21-22-23(18)11-6-3-2-4-7-11/h2-4,6-7H,5,8-10H2,1H3,(H,19,24)
InChIKey AUIWHRUXDDZUJK-UHFFFAOYSA-N
Mol Weight 415.49 g/mol
Molecular Formula C18H17N5O3S2
Exact Mass 415.077282 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Fcg2zG09q5w
Name 4H-cyclopenta[b]thiophene-3-carboxylic acid, 5,6-dihydro-2-[[[(1-phenyl-1H-tetrazol-5-yl)thio]acetyl]amino]-, methyl 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/C18H17N5O3S2/c1-26-17(25)15-12-8-5-9-13(12)28-16(15)19-14(24)10-27-18-20-21-22-23(18)11-6-3-2-4-7-11/h2-4,6-7H,5,8-10H2,1H3,(H,19,24)
InChIKey AUIWHRUXDDZUJK-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_854
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/11228540