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4-(Carbamoylmethylthio)-3-phenylfuroxan
SpectraBase Compound ID 1DNiHRpeGYt
InChI InChI=1S/C10H9N3O3S/c11-8(14)6-17-10-9(13(15)16-12-10)7-4-2-1-3-5-7/h1-5H,6H2,(H2,11,14)
InChIKey CQAAPTJLERNQJT-UHFFFAOYSA-N
Mol Weight 251.26 g/mol
Molecular Formula C10H9N3O3S
Exact Mass 251.036462 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Je7hcTM5jJG
Name 4-(Carbamoylmethylthio)-3-phenylfuroxan
Alternate Name(s) 2-[(5-oxidanidyl-4-phenyl-1,2,5-oxadiazol-5-ium-3-yl)sulfanyl]ethanamide 2-[(5-oxido-4-phenyl-1,2,5-oxadiazol-5-ium-3-yl)sulfanyl]acetamide 2-[(5-oxido-4-phenyl-1,2,5-oxadiazol-5-ium-3-yl)thio]acetamide 2-[(5-oxido-4-phenyl-furazan-5-ium-3-yl)thio]acetamide
Comments Less than 3 mono-isotopic peaks
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Formula C10H9N3O3S
InChI InChI=1S/C10H9N3O3S/c11-8(14)6-17-10-9(13(15)16-12-10)7-4-2-1-3-5-7/h1-5H,6H2,(H2,11,14)
InChIKey CQAAPTJLERNQJT-UHFFFAOYSA-N
Molecular Weight 251.260 g/mol
SMILES NC(CSc1no[n+](c1-c1ccccc1)[O-])=O
SPLASH splash10-0006-0900000000-e0fc1847e218355a16ff
Source of Spectrum K-2001-1754-3
Wiley ID 1579324