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5,6-Dihydro-8-oxo-9-phenyl-8H-pyrido[1,2-d]thieno[2,3-f][1,4]thiazepine-11-carboxylic Acid
SpectraBase Compound ID o0tnDH411A
InChI InChI=1S/C18H13NO3S2/c20-17-12(11-4-2-1-3-5-11)10-13(18(21)22)15-16-14(6-8-24-16)23-9-7-19(15)17/h1-6,8,10H,7,9H2,(H,21,22)
InChIKey RDSVVZLWGABBHR-UHFFFAOYSA-N
Mol Weight 355.43 g/mol
Molecular Formula C18H13NO3S2
Exact Mass 355.033686 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8dpWUid9Alo
Name 5,6-Dihydro-8-oxo-9-phenyl-8H-pyrido[1,2-d]thieno[2,3-f][1,4]thiazepine-11-carboxylic Acid
Alternate Name(s) 8-Oxo-9-phenyl-5,6-dihydro-8H-pyrido[1,2-d]thieno[2,3-f][1,4]thiazepine-11-carboxylic acid
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Formula C18H13NO3S2
InChI InChI=1S/C18H13NO3S2/c20-17-12(11-4-2-1-3-5-11)10-13(18(21)22)15-16-14(6-8-24-16)23-9-7-19(15)17/h1-6,8,10H,7,9H2,(H,21,22)
InChIKey RDSVVZLWGABBHR-UHFFFAOYSA-N
Molecular Weight 355.426 g/mol
SMILES OC(C1=C2N(CCSc3c2scc3)C(C(=C1)c1ccccc1)=O)=O
SPLASH splash10-074i-0209000000-f5babe38d433c0d06e2f
Source of Spectrum H-73-777-0
Wiley ID 1345172