4-[(5-methylol-2-thioxo-4-imidazolin-1-yl)methyl]benzoic acid

SpectraBase Compound ID	IGaq6nDmc1F
InChI	InChI=1S/C12H12N2O3S/c15-7-10-5-13-12(18)14(10)6-8-1-3-9(4-2-8)11(16)17/h1-5,15H,6-7H2,(H,13,18)(H,16,17)
InChIKey	WWECBLHSPLOYNU-UHFFFAOYSA-N Google Search
Mol Weight	264.3 g/mol
Molecular Formula	C12H12N2O3S
Exact Mass	264.056863 g/mol

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SpectraBase Spectrum ID	4umpT3mp6dq
Name	4-[(5-methylol-2-thioxo-4-imidazolin-1-yl)methyl]benzoic acid
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C12H12N2O3S
InChI	InChI=1S/C12H12N2O3S/c15-7-10-5-13-12(18)14(10)6-8-1-3-9(4-2-8)11(16)17/h1-5,15H,6-7H2,(H,13,18)(H,16,17)
InChIKey	WWECBLHSPLOYNU-UHFFFAOYSA-N
Molecular Weight	264.299 g/mol
SMILES	OCc1cnc([n]1Cc1ccc(C(=O)O)cc1)S
SPLASH	splash10-08g1-2980000000-aff0a11e849a4a7ddf10
Source of Spectrum	Y-39-370-1
Synonyms	4-[[4-(hydroxymethyl)-2-sulfanylidene-1H-imidazol-3-yl]methyl]benzoic acid 4-[[4-(hydroxymethyl)-2-thioxo-1H-imidazol-3-yl]methyl]benzoic acid
Wiley ID	1528460