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pyrano[2,3-c]pyrazole-5-carbonitrile, 6-amino-1,4-dihydro-4-[4-(methylthio)phenyl]-3-(4-nitrophenyl)-
SpectraBase Compound ID 8THTMxwulIj
InChI InChI=1S/C20H15N5O3S/c1-29-14-8-4-11(5-9-14)16-15(10-21)19(22)28-20-17(16)18(23-24-20)12-2-6-13(7-3-12)25(26)27/h2-9,16H,22H2,1H3,(H,23,24)
InChIKey DVWFVGUVXFRQJI-UHFFFAOYSA-N
Mol Weight 405.43 g/mol
Molecular Formula C20H15N5O3S
Exact Mass 405.089561 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HV64fhpnOdj
Name pyrano[2,3-c]pyrazole-5-carbonitrile, 6-amino-1,4-dihydro-4-[4-(methylthio)phenyl]-3-(4-nitrophenyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 405.089560534 u
Formula C20H15N5O3S
InChI InChI=1S/C20H15N5O3S/c1-29-14-8-4-11(5-9-14)16-15(10-21)19(22)28-20-17(16)18(23-24-20)12-2-6-13(7-3-12)25(26)27/h2-9,16H,22H2,1H3,(H,23,24)
InChIKey DVWFVGUVXFRQJI-UHFFFAOYSA-N
Molecular Weight 405.432 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_5452
Solvent DMSO-d6
Source Vendor ID: NMR/9290633; Lab Info: VUR; Lab Number: VUR-0000511