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Ethyl N-(2,3-dihydro-1,5-benzothiazepin-4-yl) aminoacetate
SpectraBase Compound ID BfJBvqG0loL
InChI InChI=1S/C13H16N2O2S/c1-2-17-13(16)9-14-12-7-8-18-11-6-4-3-5-10(11)15-12/h3-6H,2,7-9H2,1H3,(H,14,15)
InChIKey ITAQNOROGXWADU-UHFFFAOYSA-N
Mol Weight 264.34 g/mol
Molecular Formula C13H16N2O2S
Exact Mass 264.093249 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L2fslIgN8Wp
Name Ethyl N-(2,3-dihydro-1,5-benzothiazepin-4-yl) aminoacetate
Alternate Name(s) Ethyl (2,3-dihydro-1,5-benzothiazepin-4-ylamino)acetate
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Formula C13H16N2O2S
InChI InChI=1S/C13H16N2O2S/c1-2-17-13(16)9-14-12-7-8-18-11-6-4-3-5-10(11)15-12/h3-6H,2,7-9H2,1H3,(H,14,15)
InChIKey ITAQNOROGXWADU-UHFFFAOYSA-N
Molecular Weight 264.343 g/mol
SMILES N(C1=Nc2c(SCC1)cccc2)CC(=O)OCC
SPLASH splash10-03di-0960000000-50dfd003117f940c511a
Source of Spectrum AH-123-1025-5
Wiley ID 1267667