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1-(4-Methylsulfanyl-2H-1,5-benzothiazepin-5-yl)-2-phenoxy-ethanone
SpectraBase Compound ID 1TT6clvwtJm
InChI InChI=1S/C18H17NO2S2/c1-22-18-11-12-23-16-10-6-5-9-15(16)19(18)17(20)13-21-14-7-3-2-4-8-14/h2-11H,12-13H2,1H3
InChIKey LEIDGAAYHMUPBL-UHFFFAOYSA-N
Mol Weight 343.46 g/mol
Molecular Formula C18H17NO2S2
Exact Mass 343.070071 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ESKQ0ExiiZp
Name 1-(4-Methylsulfanyl-2H-1,5-benzothiazepin-5-yl)-2-phenoxy-ethanone
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Formula C18H17NO2S2
InChI InChI=1S/C18H17NO2S2/c1-22-18-11-12-23-16-10-6-5-9-15(16)19(18)17(20)13-21-14-7-3-2-4-8-14/h2-11H,12-13H2,1H3
InChIKey LEIDGAAYHMUPBL-UHFFFAOYSA-N
Molecular Weight 343.459 g/mol
SMILES C=1(N(c2c(SCC1)cccc2)C(COc1ccccc1)=O)SC
SPLASH splash10-05mk-0590000000-5fc8035649f085f052bd
Source of Spectrum Y-34-826-36
Synonyms 1-[4-(methylthio)-2H-1,5-benzothiazepin-5-yl]-2-phenoxy-ethanone 1-[4-(methylthio)-2H-1,5-benzothiazepin-5-yl]-2-phenoxyethanone
Wiley ID 1337226