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2-{[3-(4-chloro-1H-pyrazol-1-yl)propanoyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
SpectraBase Compound ID GRqT1dVt2Lq
InChI InChI=1S/C15H17ClN4O2S/c16-9-7-18-20(8-9)6-5-12(21)19-15-13(14(17)22)10-3-1-2-4-11(10)23-15/h7-8H,1-6H2,(H2,17,22)(H,19,21)
InChIKey VPNWMUMRGCZPMK-UHFFFAOYSA-N
Mol Weight 352.84 g/mol
Molecular Formula C15H17ClN4O2S
Exact Mass 352.076075 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FHCD3ia2P5
Name 2-{[3-(4-chloro-1H-pyrazol-1-yl)propanoyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
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/C15H17ClN4O2S/c16-9-7-18-20(8-9)6-5-12(21)19-15-13(14(17)22)10-3-1-2-4-11(10)23-15/h7-8H,1-6H2,(H2,17,22)(H,19,21)
InChIKey VPNWMUMRGCZPMK-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_1017
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: UZI/1206761; Labnumber: AC-NHALL/0422940; UZI_ID: UZI-001019
Temperature 318 °C