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6-amino-3-tert-butyl-4-[2-(trifluoromethyl)phenyl]-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
SpectraBase Compound ID DwNrUjbz72G
InChI InChI=1S/C18H17F3N4O/c1-17(2,3)14-13-12(9-6-4-5-7-11(9)18(19,20)21)10(8-22)15(23)26-16(13)25-24-14/h4-7,12H,23H2,1-3H3,(H,24,25)
InChIKey FZOAXUCXDQGNNQ-UHFFFAOYSA-N
Mol Weight 362.36 g/mol
Molecular Formula C18H17F3N4O
Exact Mass 362.135446 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BqrpCIAlx2h
Name pyrano[2,3-c]pyrazole-5-carbonitrile, 6-amino-3-(1,1-dimethylethyl)-2,4-dihydro-4-[2-(trifluoromethyl)phenyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 362.135445671 u
Formula C18H17F3N4O
InChI InChI=1S/C18H17F3N4O/c1-17(2,3)14-13-12(9-6-4-5-7-11(9)18(19,20)21)10(8-22)15(23)26-16(13)25-24-14/h4-7,12H,23H2,1-3H3,(H,24,25)
InChIKey FZOAXUCXDQGNNQ-UHFFFAOYSA-N
Molecular Weight 362.356 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_2257
Solvent DMSO-d6
Source Vendor ID: ZI/8162506; Lab Info: TSH; Lab Number: TSH-f000232
Temperature 29.85 °C