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7-methylene-12H-benzimidazolo[2,1-c][2,4]benzothiazepine 6,6-dioxide
SpectraBase Compound ID H51PAtP5EiU
InChI InChI=1S/C16H12N2O2S/c1-11-13-7-3-2-6-12(13)10-18-15-9-5-4-8-14(15)17-16(18)21(11,19)20/h2-9H,1,10H2
InChIKey RPYFKCVAWNHGFL-UHFFFAOYSA-N
Mol Weight 296.34 g/mol
Molecular Formula C16H12N2O2S
Exact Mass 296.061949 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3Lxn7Avkn87
Name 7-methylene-12H-benzimidazolo[2,1-c][2,4]benzothiazepine 6,6-dioxide
Alternate Name(s) 7-methylidene-12H-benzimidazolo[2,1-c][2,4]benzothiazepine 6,6-dioxide
Comments Less than 3 mono-isotopic peaks
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Formula C16H12N2O2S
InChI InChI=1S/C16H12N2O2S/c1-11-13-7-3-2-6-12(13)10-18-15-9-5-4-8-14(15)17-16(18)21(11,19)20/h2-9H,1,10H2
InChIKey RPYFKCVAWNHGFL-UHFFFAOYSA-N
Molecular Weight 296.344 g/mol
SMILES c12S(C(c3c(C[n]2c2ccccc2n1)cccc3)=C)(=O)=O
SPLASH splash10-001i-0090000000-629c3d77701f18491605
Source of Spectrum KC-0-76-24
Wiley ID 827257