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3,4-Dihydro-2H-1,5-benzothiazepine-5-carbaldehyde

View entire compound with spectra: 1 MS (GC)

3,4-Dihydro-2H-1,5-benzothiazepine-5-carbaldehyde
SpectraBase Compound ID BStn08iflVN
InChI InChI=1S/C10H11NOS/c12-8-11-6-3-7-13-10-5-2-1-4-9(10)11/h1-2,4-5,8H,3,6-7H2
InChIKey KANPXFDREDSSOO-UHFFFAOYSA-N
Mol Weight 193.26 g/mol
Molecular Formula C10H11NOS
Exact Mass 193.056135 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GKV8N3NrpPe
Name 3,4-Dihydro-2H-1,5-benzothiazepine-5-carbaldehyde
Alternate Name(s) 3,4-Dihydro-2H-1,5-benzothiazepine-5-carboxaldehyde
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Formula C10H11NOS
InChI InChI=1S/C10H11NOS/c12-8-11-6-3-7-13-10-5-2-1-4-9(10)11/h1-2,4-5,8H,3,6-7H2
InChIKey KANPXFDREDSSOO-UHFFFAOYSA-N
Molecular Weight 193.264 g/mol
SMILES c12N(CCCSc2cccc1)C=O
SPLASH splash10-000l-0900000000-dcb0b09303980bc1e1a4
Source of Spectrum J-60-2604-11
Wiley ID 1189478