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4-(3'-Chloropropanoyl)-4,5,6,7-tetrahydrothieno[2,3-b]-(1,4)-thiazepine
SpectraBase Compound ID 7dex39O1Ten
InChI InChI=1S/C10H12ClNOS2/c11-4-2-9(13)12-5-1-6-14-10-8(12)3-7-15-10/h3,7H,1-2,4-6H2
InChIKey OWZYLGWGFGYSEI-UHFFFAOYSA-N
Mol Weight 261.78 g/mol
Molecular Formula C10H12ClNOS2
Exact Mass 261.004884 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DUEQJGNgPhb
Name 4-(3'-Chloropropanoyl)-4,5,6,7-tetrahydrothieno[2,3-b]-(1,4)-thiazepine
Alternate Name(s) 4-(3-Chloropropanoyl)-4,5,6,7-tetrahydrothieno[2,3-b][1,4]thiazepine
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Formula C10H12ClNOS2
InChI InChI=1S/C10H12ClNOS2/c11-4-2-9(13)12-5-1-6-14-10-8(12)3-7-15-10/h3,7H,1-2,4-6H2
InChIKey OWZYLGWGFGYSEI-UHFFFAOYSA-N
Molecular Weight 261.785 g/mol
SMILES c12N(C(CCCl)=O)CCCSc2scc1
SPLASH splash10-03kc-5690000000-c5ffb461a7cd401009a7
Source of Spectrum D8-328-316-16
Wiley ID 1515851