3-[3-(3-cyanopropoxy)-4-methoxyphenyl]benzo[f]quinoline-1-carboxylic acid

SpectraBase Compound ID	3C7OEsYPn5z
InChI	InChI=1S/C25H20N2O4/c1-30-22-11-9-17(14-23(22)31-13-5-4-12-26)21-15-19(25(28)29)24-18-7-3-2-6-16(18)8-10-20(24)27-21/h2-3,6-11,14-15H,4-5,13H2,1H3,(H,28,29)
InChIKey	ZQJWWRMMYASGQE-UHFFFAOYSA-N Google Search
Mol Weight	412.45 g/mol
Molecular Formula	C25H20N2O4
Exact Mass	412.142307 g/mol

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SpectraBase Spectrum ID	Faa76FMZLPN
Name	3-[3-(3-cyanopropoxy)-4-methoxyphenyl]benzo[f]quinoline-1-carboxylic 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/C25H20N2O4/c1-30-22-11-9-17(14-23(22)31-13-5-4-12-26)21-15-19(25(28)29)24-18-7-3-2-6-16(18)8-10-20(24)27-21/h2-3,6-11,14-15H,4-5,13H2,1H3,(H,28,29)
InChIKey	ZQJWWRMMYASGQE-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_ASIOH_7000_6088
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: NMR/11242299; Labnumber: SAD-0002943; IOH_ID: IOH-006089