[2-[3,5-bis(hydroxymethyl)-1,2,4-triazol-4-yl]-5-chloranyl-phenyl]-phenyl-methanone

SpectraBase Compound ID	H8dnahBpACc
InChI	InChI=1S/C17H14ClN3O3/c18-12-6-7-14(21-15(9-22)19-20-16(21)10-23)13(8-12)17(24)11-4-2-1-3-5-11/h1-8,22-23H,9-10H2
InChIKey	XFOGNFPUZNSRCS-UHFFFAOYSA-N Google Search
Mol Weight	343.77 g/mol
Molecular Formula	C17H14ClN3O3
Exact Mass	343.072369 g/mol

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SpectraBase Spectrum ID	LKwPeY3uKH7
Name	[2-[3,5-bis(hydroxymethyl)-1,2,4-triazol-4-yl]-5-chloranyl-phenyl]-phenyl-methanone
CAS Registry Number	54485-86-8
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C17H14ClN3O3
InChI	InChI=1S/C17H14ClN3O3/c18-12-6-7-14(21-15(9-22)19-20-16(21)10-23)13(8-12)17(24)11-4-2-1-3-5-11/h1-8,22-23H,9-10H2
InChIKey	XFOGNFPUZNSRCS-UHFFFAOYSA-N
Molecular Weight	343.770 g/mol
SMILES	OCc1nnc(CO)[n]1-c1c(C(=O)c2ccccc2)cc(cc1)Cl
SPLASH	splash10-0002-0079000000-4cc0724bec90a9386a62
Source of Spectrum	Y-17-580-0
Synonyms	[2-[3,5-bis(hydroxymethyl)-1,2,4-triazol-4-yl]-5-chloro-phenyl]-phenyl-methanone [5-chloro-2-(3,5-dimethylol-1,2,4-triazol-4-yl)phenyl]-phenyl-methanone
Wiley ID	1337205