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5-(4-bromophenyl)-3-chloro-N-(3-methoxy-5-nitrophenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide

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5-(4-bromophenyl)-3-chloro-N-(3-methoxy-5-nitrophenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
SpectraBase Compound ID BT18TS6uP2z
InChI InChI=1S/C21H16BrClF3N5O4/c1-35-14-7-12(6-13(8-14)31(33)34)27-20(32)18-17(23)19-28-15(10-2-4-11(22)5-3-10)9-16(21(24,25)26)30(19)29-18/h2-8,15-16,28H,9H2,1H3,(H,27,32)
InChIKey YPYCIOOKWYCBEY-UHFFFAOYSA-N
Mol Weight 574.74 g/mol
Molecular Formula C21H16BrClF3N5O4
Exact Mass 573.002629 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID L21MG2wjjte
Name 5-(4-bromophenyl)-3-chloro-N-(3-methoxy-5-nitrophenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-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/C21H16BrClF3N5O4/c1-35-14-7-12(6-13(8-14)31(33)34)27-20(32)18-17(23)19-28-15(10-2-4-11(22)5-3-10)9-16(21(24,25)26)30(19)29-18/h2-8,15-16,28H,9H2,1H3,(H,27,32)
InChIKey YPYCIOOKWYCBEY-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_12145
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/9100190; UBI_ID: UBI-012148
Temperature 308 °C