5-Mercapto-1H-[1,2,3]triazole-4-carboxylic acid cyclohexyl ester

SpectraBase Compound ID	vgjwBY2agE
InChI	InChI=1S/C9H13N3O2S/c13-9(7-8(15)11-12-10-7)14-6-4-2-1-3-5-6/h6H,1-5H2,(H2,10,11,12,15)
InChIKey	YIDVLLAHPGSNSC-UHFFFAOYSA-N Google Search
Mol Weight	227.28 g/mol
Molecular Formula	C9H13N3O2S
Exact Mass	227.072848 g/mol

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SpectraBase Spectrum ID	IGYbC1fdGp
Name	5-Mercapto-1H-[1,2,3]triazole-4-carboxylic acid cyclohexyl ester
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C9H13N3O2S
InChI	InChI=1S/C9H13N3O2S/c13-9(7-8(15)11-12-10-7)14-6-4-2-1-3-5-6/h6H,1-5H2,(H2,10,11,12,15)
InChIKey	YIDVLLAHPGSNSC-UHFFFAOYSA-N
Molecular Weight	227.282 g/mol
SMILES	[nH]1c(c(nn1)C(OC1CCCCC1)=O)S
SPLASH	splash10-004j-3910000000-666012b0474feb7108d9
Synonyms	5-sulfanylidene-1,2-dihydrotriazole-4-carboxylic acid cyclohexyl ester 5-Thioxo-1,2-dihydrotriazole-4-carboxylic acid cyclohexyl ester cyclohexyl 5-sulfanylidene-1,2-dihydro-1,2,3-triazole-4-carboxylate cyclohexyl 5-sulfanylidene-1,2-dihydrotriazole-4-carboxylate cyclohexyl 5-thioxo-1,2-dihydrotriazole-4-carboxylate
Wiley ID	1465828