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Acetamide, N-[(2-hydroxy-4-nitrophenyl)methyl]-N-(1-methylethyl)-2-[(1-phenyl-1H-tetrazol-5-yl)thio]-
SpectraBase Compound ID 9ZAEh4U7eqw
InChI InChI=1S/C19H20N6O4S/c1-13(2)23(11-14-8-9-16(25(28)29)10-17(14)26)18(27)12-30-19-20-21-22-24(19)15-6-4-3-5-7-15/h3-10,13,26H,11-12H2,1-2H3
InChIKey RLOVRACSPQCOIL-UHFFFAOYSA-N
Mol Weight 428.47 g/mol
Molecular Formula C19H20N6O4S
Exact Mass 428.126674 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 32utPKCROKf
Name Acetamide, N-[(2-hydroxy-4-nitrophenyl)methyl]-N-(1-methylethyl)-2-[(1-phenyl-1H-tetrazol-5-yl)thio]-
Alternate Name(s) N-(2-hydroxy-4-nitrobenzyl)-N-isopropyl-2-((1-phenyl-1H-tetrazol-5-yl)thio)acetamide N-(2-hydroxy-4-nitrobenzyl)-2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]-N-(propan-2-yl)acetamide N-[(2-hydroxy-4-nitrophenyl)methyl]-2-[(1-phenyl-5-tetrazolyl)thio]-N-propan-2-ylacetamide N-[(2-hydroxy-4-nitrophenyl)methyl]-2-(1-phenyltetrazol-5-yl)sulfanyl-N-propan-2-ylacetamide N-[(2-hydroxy-4-nitro-phenyl)methyl]-N-isopropyl-2-(1-phenyltetrazol-5-yl)sulfanyl-acetamide N-[(4-nitro-2-oxidanyl-phenyl)methyl]-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-N-propan-2-yl-ethanamide
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Formula C19H20N6O4S
InChI InChI=1S/C19H20N6O4S/c1-13(2)23(11-14-8-9-16(25(28)29)10-17(14)26)18(27)12-30-19-20-21-22-24(19)15-6-4-3-5-7-15/h3-10,13,26H,11-12H2,1-2H3
InChIKey RLOVRACSPQCOIL-UHFFFAOYSA-N
Molecular Weight 428.467 g/mol
SMILES Oc1c(CN(C(=O)CSc2nnn[n]2-c2ccccc2)C(C)C)ccc(c1)[N+]([O-])=O
SPLASH splash10-0fr6-9710000000-23d8dcfee39ca4acca87
Source of Spectrum JX-2015-4-367
Wiley ID 1725809