2-amino-4-{3-[(3-chloro-4-fluorophenoxy)methyl]-4-methoxyphenyl}-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile

SpectraBase Compound ID	5dgaIFWYoOR
InChI	InChI=1S/C24H20ClFN2O4/c1-30-20-8-5-13(9-14(20)12-31-15-6-7-18(26)17(25)10-15)22-16(11-27)24(28)32-21-4-2-3-19(29)23(21)22/h5-10,22H,2-4,12,28H2,1H3
InChIKey	FUDJRHYVBPPWMR-UHFFFAOYSA-N Google Search
Mol Weight	454.89 g/mol
Molecular Formula	C24H20ClFN2O4
Exact Mass	454.109563 g/mol

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SpectraBase Spectrum ID	ImL5bJrG9Rk
Name	2-amino-4-{3-[(3-chloro-4-fluorophenoxy)methyl]-4-methoxyphenyl}-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
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/C24H20ClFN2O4/c1-30-20-8-5-13(9-14(20)12-31-15-6-7-18(26)17(25)10-15)22-16(11-27)24(28)32-21-4-2-3-19(29)23(21)22/h5-10,22H,2-4,12,28H2,1H3
InChIKey	FUDJRHYVBPPWMR-UHFFFAOYSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI_21270_3455
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: 9313475; UBI_ID: UBI-003456
Temperature	308 °C