4-[(1Z)-2-cyano-3-(cyclohexylamino)-3-oxo-1-propenyl]benzoic acid

SpectraBase Compound ID	HU4bN1GHedg
InChI	InChI=1S/C17H18N2O3/c18-11-14(16(20)19-15-4-2-1-3-5-15)10-12-6-8-13(9-7-12)17(21)22/h6-10,15H,1-5H2,(H,19,20)(H,21,22)/b14-10-
InChIKey	BIIXYKJOIAURGG-UVTDQMKNSA-N Google Search
Mol Weight	298.34 g/mol
Molecular Formula	C17H18N2O3
Exact Mass	298.131742 g/mol

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SpectraBase Spectrum ID	4wPiNdzTSQA
Name	4-[(1Z)-2-cyano-3-(cyclohexylamino)-3-oxo-1-propenyl]benzoic acid
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/C17H18N2O3/c18-11-14(16(20)19-15-4-2-1-3-5-15)10-12-6-8-13(9-7-12)17(21)22/h6-10,15H,1-5H2,(H,19,20)(H,21,22)/b14-10-
InChIKey	BIIXYKJOIAURGG-UVTDQMKNSA-N
NMR Offset	15.3537
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI_21270_6210
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: 62667; UBI_ID: UBI-006212
Synonyms	4-[2-cyano-3-(cyclohexylamino)-3-oxo-1-propenyl]benzoic acid
Temperature	308 °C