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propyl 2-{[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID IEQDHCYYlfM
InChI InChI=1S/C19H24BrN3O3S/c1-4-9-26-19(25)16-13-7-5-6-8-14(13)27-18(16)21-15(24)10-23-12(3)17(20)11(2)22-23/h4-10H2,1-3H3,(H,21,24)
InChIKey JLXCWHDFTZYPJM-UHFFFAOYSA-N
Mol Weight 454.38 g/mol
Molecular Formula C19H24BrN3O3S
Exact Mass 453.072176 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2Wrpjp1uuy2
Name propyl 2-{[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
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/C19H24BrN3O3S/c1-4-9-26-19(25)16-13-7-5-6-8-14(13)27-18(16)21-15(24)10-23-12(3)17(20)11(2)22-23/h4-10H2,1-3H3,(H,21,24)
InChIKey JLXCWHDFTZYPJM-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_5028
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/8141342; UBI_ID: UBI-005030
Temperature 313 °C