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6-Nitro-2-bethzoylmethyl-1,2-benzisothiazol-3-one-1-oxide
SpectraBase Compound ID HXAOJhkiQ7P
InChI InChI=1S/C15H10N2O5S/c18-13(10-4-2-1-3-5-10)9-16-15(19)12-7-6-11(17(20)21)8-14(12)23(16)22/h1-8H,9H2
InChIKey WBQFRHPPRHEKRH-UHFFFAOYSA-N
Mol Weight 330.31 g/mol
Molecular Formula C15H10N2O5S
Exact Mass 330.031043 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GrPAonTgEgw
Name 6-Nitro-2-bethzoylmethyl-1,2-benzisothiazol-3-one-1-oxide
Alternate Name(s) 6-Nitro-2-benzoylmethyl-1,2-benzisothiazol-3-one-1-oxide 6-Nitro-1-oxo-2-phenacyl-1,2-benzothiazol-3-one 6-Nitro-1-oxidanylidene-2-phenacyl-1,2-benzothiazol-3-one
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Formula C15H10N2O5S
InChI InChI=1S/C15H10N2O5S/c18-13(10-4-2-1-3-5-10)9-16-15(19)12-7-6-11(17(20)21)8-14(12)23(16)22/h1-8H,9H2
InChIKey WBQFRHPPRHEKRH-UHFFFAOYSA-N
Molecular Weight 330.314 g/mol
SMILES c12S(N(C(c1ccc(c2)N(=O)=O)=O)CC(=O)c1ccccc1)=O
SPLASH splash10-0002-0910000000-3f3ab0826124cdc6cf35
Source of Spectrum SO-0-1663-5
Wiley ID 878626