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pyrano[2,3-c]pyrazole-5-carbonitrile, 6-amino-4-(5-bromo-2-fluorophenyl)-3-(1,1-dimethylethyl)-1,4-dihydro-
SpectraBase Compound ID 391MC0b7hoy
InChI InChI=1S/C17H16BrFN4O/c1-17(2,3)14-13-12(9-6-8(18)4-5-11(9)19)10(7-20)15(21)24-16(13)23-22-14/h4-6,12H,21H2,1-3H3,(H,22,23)
InChIKey MFTOTHLPVGIHJN-UHFFFAOYSA-N
Mol Weight 391.24 g/mol
Molecular Formula C17H16BrFN4O
Exact Mass 390.049152 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8xdb2p6qUs8
Name pyrano[2,3-c]pyrazole-5-carbonitrile, 6-amino-4-(5-bromo-2-fluorophenyl)-3-(1,1-dimethylethyl)-1,4-dihydro-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 390.049152313 u
Formula C17H16BrFN4O
InChI InChI=1S/C17H16BrFN4O/c1-17(2,3)14-13-12(9-6-8(18)4-5-11(9)19)10(7-20)15(21)24-16(13)23-22-14/h4-6,12H,21H2,1-3H3,(H,22,23)
InChIKey MFTOTHLPVGIHJN-UHFFFAOYSA-N
Molecular Weight 391.244 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_5120
Solvent DMSO-d6
Source Vendor ID: NMR/9302472; Lab Info: VUR; Lab Number: VUR-0000764