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4H-cyclopenta[b]thiophene-3-carboxylic acid, 2-[[(1H-benzimidazol-2-ylthio)acetyl]amino]-5,6-dihydro-, ethyl ester
SpectraBase Compound ID HjMzQrCjsUT
InChI InChI=1S/C19H19N3O3S2/c1-2-25-18(24)16-11-6-5-9-14(11)27-17(16)22-15(23)10-26-19-20-12-7-3-4-8-13(12)21-19/h3-4,7-8H,2,5-6,9-10H2,1H3,(H,20,21)(H,22,23)
InChIKey BRRHLKWSHJNQCQ-UHFFFAOYSA-N
Mol Weight 401.5 g/mol
Molecular Formula C19H19N3O3S2
Exact Mass 401.086784 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1ietprQNU0X
Name 4H-cyclopenta[b]thiophene-3-carboxylic acid, 2-[[(1H-benzimidazol-2-ylthio)acetyl]amino]-5,6-dihydro-, 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/C19H19N3O3S2/c1-2-25-18(24)16-11-6-5-9-14(11)27-17(16)22-15(23)10-26-19-20-12-7-3-4-8-13(12)21-19/h3-4,7-8H,2,5-6,9-10H2,1H3,(H,20,21)(H,22,23)
InChIKey BRRHLKWSHJNQCQ-UHFFFAOYSA-N
NMR Offset 15.8701
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_8516_6292
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: ZI/6041271; Labnumber: SMN-0077693; IOH_ID: IOH-013295
Temperature 313 °C