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pyrano[2,3-c]pyrazole-5-carbonitrile, 6-amino-1,4-dihydro-4-[4-(methylthio)phenyl]-3-phenyl-
SpectraBase Compound ID 25VzOm3iXSN
InChI InChI=1S/C20H16N4OS/c1-26-14-9-7-12(8-10-14)16-15(11-21)19(22)25-20-17(16)18(23-24-20)13-5-3-2-4-6-13/h2-10,16H,22H2,1H3,(H,23,24)
InChIKey AOCCVYRSUHPQIB-UHFFFAOYSA-N
Mol Weight 360.44 g/mol
Molecular Formula C20H16N4OS
Exact Mass 360.104482 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 73meruSHk7s
Name pyrano[2,3-c]pyrazole-5-carbonitrile, 6-amino-1,4-dihydro-4-[4-(methylthio)phenyl]-3-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 360.104482324 u
Formula C20H16N4OS
InChI InChI=1S/C20H16N4OS/c1-26-14-9-7-12(8-10-14)16-15(11-21)19(22)25-20-17(16)18(23-24-20)13-5-3-2-4-6-13/h2-10,16H,22H2,1H3,(H,23,24)
InChIKey AOCCVYRSUHPQIB-UHFFFAOYSA-N
Molecular Weight 360.435 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_5279
Solvent DMSO-d6
Source Vendor ID: NMR/9290817; Lab Info: VUR; Lab Number: VUR-0000546