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(3S,4R)-1-(2-Allylsulfanyl-phenyl)-2-oxo-4-phenyl-azetidine-3-carboxylic acid ethyl ester
SpectraBase Compound ID 3smoE8I85Ok
InChI InChI=1S/C21H21NO3S/c1-3-14-26-17-13-9-8-12-16(17)22-19(15-10-6-5-7-11-15)18(20(22)23)21(24)25-4-2/h3,5-13,18-19H,1,4,14H2,2H3/t18-,19-/m0/s1
InChIKey DVSRLTPYNJPXEK-OALUTQOASA-N
Mol Weight 367.46 g/mol
Molecular Formula C21H21NO3S
Exact Mass 367.124215 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4FqokxUnjEn
Name (3S,4R)-1-(2-Allylsulfanyl-phenyl)-2-oxo-4-phenyl-azetidine-3-carboxylic acid ethyl ester
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Formula C21H21NO3S
InChI InChI=1S/C21H21NO3S/c1-3-14-26-17-13-9-8-12-16(17)22-19(15-10-6-5-7-11-15)18(20(22)23)21(24)25-4-2/h3,5-13,18-19H,1,4,14H2,2H3/t18-,19-/m0/s1
InChIKey DVSRLTPYNJPXEK-OALUTQOASA-N
Molecular Weight 367.463 g/mol
SMILES C1(N([C@]([C@@]1(C(=O)OCC)[H])(c1ccccc1)[H])c1c(SCC=C)cccc1)=O
SPLASH splash10-015c-0916000000-b5ee93b25194300615c8
Source of Spectrum F-54-9698-11
Synonyms Ethyl (3S,4R)-1-[2-(allylsulfanyl)phenyl]-2-oxo-4-phenyl-3-azetidinecarboxylate trans-Ethyl 1-[2-(allylthio)phenyl]-2-oxo-4-phenylazetidine-3-carboxylate
Wiley ID 808179