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10-(1,3-benzodioxol-5-yl)-4,10-dihydro-1H,3H-furo[3,4-c][1,5]benzothiazepin-1-one
SpectraBase Compound ID 4RYAEAWY5Nt
InChI InChI=1S/C18H13NO4S/c20-18-16-12(8-21-18)19-11-3-1-2-4-15(11)24-17(16)10-5-6-13-14(7-10)23-9-22-13/h1-7,17,19H,8-9H2
InChIKey OJUMOKMDJSUJHL-UHFFFAOYSA-N
Mol Weight 339.37 g/mol
Molecular Formula C18H13NO4S
Exact Mass 339.056529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KoZLVwhHtM4
Name 10-(1,3-benzodioxol-5-yl)-4,10-dihydro-1H,3H-furo[3,4-c][1,5]benzothiazepin-1-one
CAS Registry Number 87192-11-8
Comments Less than 3 mono-isotopic peaks
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Formula C18H13NO4S
InChI InChI=1S/C18H13NO4S/c20-18-16-12(8-21-18)19-11-3-1-2-4-15(11)24-17(16)10-5-6-13-14(7-10)23-9-22-13/h1-7,17,19H,8-9H2
InChIKey OJUMOKMDJSUJHL-UHFFFAOYSA-N
Molecular Weight 339.365 g/mol
SMILES N1c2ccccc2SC(C2=C1COC2=O)c1cc2OCOc2cc1
SPLASH splash10-001i-0095000000-ef3ceaf7fb2285bfe264
Source of Spectrum J-48-4369-0
Synonyms 4-(1,3-benzodioxol-5-yl)-4,10-dihydro-1H-furo[3,4-c][1,5]benzothiazepin-3-one
Wiley ID 1334431