alanine, 2-[2-(3-chlorophenyl)hydrazino]-3,3,3-trifluoro-N-(2-methylbenzoyl)-, methyl ester

SpectraBase Compound ID	8YrbotktIJF
InChI	InChI=1S/C18H17ClF3N3O3/c1-11-6-3-4-9-14(11)15(26)23-17(16(27)28-2,18(20,21)22)25-24-13-8-5-7-12(19)10-13/h3-10,24-25H,1-2H3,(H,23,26)
InChIKey	HXDBZZACZUCUJH-UHFFFAOYSA-N Google Search
Mol Weight	415.8 g/mol
Molecular Formula	C18H17ClF3N3O3
Exact Mass	415.091054 g/mol

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SpectraBase Spectrum ID	9vX16NpNJVY
Name	alanine, 2-[2-(3-chlorophenyl)hydrazino]-3,3,3-trifluoro-N-(2-methylbenzoyl)-, methyl ester
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/C18H17ClF3N3O3/c1-11-6-3-4-9-14(11)15(26)23-17(16(27)28-2,18(20,21)22)25-24-13-8-5-7-12(19)10-13/h3-10,24-25H,1-2H3,(H,23,26)
InChIKey	HXDBZZACZUCUJH-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_CB_8313_7972
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/11211361; Labnumber: AU-Z000688