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({[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino]carbothioyl}sulfanyl)acetic acid
SpectraBase Compound ID BcMnWFJtHvb
InChI InChI=1S/C14H15N3O3S2/c1-9-12(15-14(21)22-8-11(18)19)13(20)17(16(9)2)10-6-4-3-5-7-10/h3-7H,8H2,1-2H3,(H,15,21)(H,18,19)
InChIKey HMQZQABPKUECKR-UHFFFAOYSA-N
Mol Weight 337.41 g/mol
Molecular Formula C14H15N3O3S2
Exact Mass 337.055484 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 28h6ImpuQRP
Name ({[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino]carbothioyl}sulfanyl)acetic 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/C14H15N3O3S2/c1-9-12(15-14(21)22-8-11(18)19)13(20)17(16(9)2)10-6-4-3-5-7-10/h3-7H,8H2,1-2H3,(H,15,21)(H,18,19)
InChIKey HMQZQABPKUECKR-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_4116
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: 120868; Labnumber: REA15-0906; VK_ID: VK-004117
Temperature 308 °C