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benzoic acid, 4-(6-amino-5-cyano-1,4-dihydro-3-phenylpyrano[2,3-c]pyrazol-4-yl)-, methyl ester
SpectraBase Compound ID 8KCfGxP2dha
InChI InChI=1S/C21H16N4O3/c1-27-21(26)14-9-7-12(8-10-14)16-15(11-22)19(23)28-20-17(16)18(24-25-20)13-5-3-2-4-6-13/h2-10,16H,23H2,1H3,(H,24,25)
InChIKey BONSHFTVXCKZDZ-UHFFFAOYSA-N
Mol Weight 372.38 g/mol
Molecular Formula C21H16N4O3
Exact Mass 372.12224 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 93x7BPTWhzX
Name benzoic acid, 4-(6-amino-5-cyano-1,4-dihydro-3-phenylpyrano[2,3-c]pyrazol-4-yl)-, methyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 372.122240388 u
Formula C21H16N4O3
InChI InChI=1S/C21H16N4O3/c1-27-21(26)14-9-7-12(8-10-14)16-15(11-22)19(23)28-20-17(16)18(24-25-20)13-5-3-2-4-6-13/h2-10,16H,23H2,1H3,(H,24,25)
InChIKey BONSHFTVXCKZDZ-UHFFFAOYSA-N
Molecular Weight 372.384 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_5601
Solvent DMSO-d6
Source Vendor ID: NMR/9290639; Lab Info: VUR; Lab Number: VUR-0000519