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6-Phenyl-5,6-dihydrotetrazolo[1,5-d][1,4]benzothiazepine
SpectraBase Compound ID 3WQUD1XvSKW
InChI InChI=1S/C15H12N4S/c1-2-6-11(7-3-1)14-10-19-15(16-17-18-19)12-8-4-5-9-13(12)20-14/h1-9,14H,10H2
InChIKey XQCYTBAJXGPHLL-UHFFFAOYSA-N
Mol Weight 280.35 g/mol
Molecular Formula C15H12N4S
Exact Mass 280.078268 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9sRzXpbhCt2
Name 6-Phenyl-5,6-dihydrotetrazolo[1,5-d][1,4]benzothiazepine
Alternate Name(s) 6-phenyl-5,6-dihydro-[1,2,3,4]tetrazolo[1,5-d][1,4]benzothiazepine
Comments Less than 3 mono-isotopic peaks
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Formula C15H12N4S
InChI InChI=1S/C15H12N4S/c1-2-6-11(7-3-1)14-10-19-15(16-17-18-19)12-8-4-5-9-13(12)20-14/h1-9,14H,10H2
InChIKey XQCYTBAJXGPHLL-UHFFFAOYSA-N
Molecular Weight 280.349 g/mol
SMILES c-12[n](nnn2)CC(c2ccccc2)Sc2c1cccc2
SPLASH splash10-001j-0790000000-bc624e3db79507243f6c
Source of Spectrum SK-25-1503-7
Wiley ID 866694