5-Amino-3-[(Z)-2-(1,3-benzodioxol-5-yl)-1-cyano-vinyl]-1-phenyl-pyrazole-4-carbonitrile

SpectraBase Compound ID	K3PUY3yOml4
InChI	InChI=1S/C20H13N5O2/c21-10-14(8-13-6-7-17-18(9-13)27-12-26-17)19-16(11-22)20(23)25(24-19)15-4-2-1-3-5-15/h1-9H,12,23H2/b14-8+
InChIKey	HIEBYJHCKUXTQE-RIYZIHGNSA-N Google Search
Mol Weight	355.36 g/mol
Molecular Formula	C20H13N5O2
Exact Mass	355.106925 g/mol

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SpectraBase Spectrum ID	H98KFQ8LzL8
Name	1H-pyrazole-3-acetonitrile, 5-amino-alpha-(1,3-benzodioxol-5-ylmethylene)-4-cyano-1-phenyl-
Author	A.V.Yarkov, IPAC, Russia
Copyright	Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI	InChI=1S/C20H13N5O2/c21-10-14(8-13-6-7-17-18(9-13)27-12-26-17)19-16(11-22)20(23)25(24-19)15-4-2-1-3-5-15/h1-9H,12,23H2/b14-8+
InChIKey	HIEBYJHCKUXTQE-RIYZIHGNSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_ASIOH_8516_7128
Owner	Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State	soluted
Solvent	DMSO-d6
Source File Reference	VendorID: SADD/5680825; IOH_ID: IOH-014132