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5-(5-methylthiophen-2-yl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carbonitrile
SpectraBase Compound ID 1pXXH4dIKQR
InChI InChI=1S/C13H11F3N4S/c1-7-2-3-10(21-7)9-4-11(13(14,15)16)20-12(19-9)8(5-17)6-18-20/h2-3,6,9,11,19H,4H2,1H3
InChIKey BTVYRQUGPDQKAD-UHFFFAOYSA-N
Mol Weight 312.31 g/mol
Molecular Formula C13H11F3N4S
Exact Mass 312.065652 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GEoxtLOV9IZ
Name 5-(5-methylthiophen-2-yl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carbonitrile
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/C13H11F3N4S/c1-7-2-3-10(21-7)9-4-11(13(14,15)16)20-12(19-9)8(5-17)6-18-20/h2-3,6,9,11,19H,4H2,1H3
InChIKey BTVYRQUGPDQKAD-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_2684
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: 1038511; UZI_ID: UZI-002686
Temperature 308 °C