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benzoic acid, 2-[6-amino-5-cyano-1,4-dihydro-3-(2-thienyl)pyrano[2,3-c]pyrazol-4-yl]-
SpectraBase Compound ID AAenxnUyVv0
InChI InChI=1S/C18H12N4O3S/c19-8-11-13(9-4-1-2-5-10(9)18(23)24)14-15(12-6-3-7-26-12)21-22-17(14)25-16(11)20/h1-7,13H,20H2,(H,21,22)(H,23,24)
InChIKey MBCDSNRTILSULC-UHFFFAOYSA-N
Mol Weight 364.38 g/mol
Molecular Formula C18H12N4O3S
Exact Mass 364.063011 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KZXMbVcrqjc
Name benzoic acid, 2-[6-amino-5-cyano-1,4-dihydro-3-(2-thienyl)pyrano[2,3-c]pyrazol-4-yl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 364.063011433 u
Formula C18H12N4O3S
InChI InChI=1S/C18H12N4O3S/c19-8-11-13(9-4-1-2-5-10(9)18(23)24)14-15(12-6-3-7-26-12)21-22-17(14)25-16(11)20/h1-7,13H,20H2,(H,21,22)(H,23,24)
InChIKey MBCDSNRTILSULC-UHFFFAOYSA-N
Molecular Weight 364.379 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_15871
Solvent DMSO-d6
Source Vendor ID: NMR/11240689; Lab Info: VUR; Lab Number: VUR-0103021