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Methyl 4-benzyl-3-oxo-5-phenyl-3,4,7,8-tetrahydro-2H-1,4-thiazocin-7-carboxylate
SpectraBase Compound ID 9UW72iCH83U
InChI InChI=1S/C21H21NO3S/c1-25-21(24)18-12-19(17-10-6-3-7-11-17)22(20(23)15-26-14-18)13-16-8-4-2-5-9-16/h2-12,18H,13-15H2,1H3/b19-12-
InChIKey YTESRBBMDNCVJR-UNOMPAQXSA-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 CqCs7dG1lbe
Name Methyl 4-benzyl-3-oxo-5-phenyl-3,4,7,8-tetrahydro-2H-1,4-thiazocin-7-carboxylate
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Formula C21H21NO3S
InChI InChI=1S/C21H21NO3S/c1-25-21(24)18-12-19(17-10-6-3-7-11-17)22(20(23)15-26-14-18)13-16-8-4-2-5-9-16/h2-12,18H,13-15H2,1H3/b19-12-
InChIKey YTESRBBMDNCVJR-UNOMPAQXSA-N
Molecular Weight 367.463 g/mol
SMILES C1(\C=C\(N(C(CSC1)=O)Cc1ccccc1)c1ccccc1)C(=O)OC
SPLASH splash10-0006-9041000000-6d993f84988f868746d1
Source of Spectrum U1-2009-5434-8a
Synonyms (5Z)-3-oxo-5-phenyl-4-(phenylmethyl)-7,8-dihydro-1,4-thiazocine-7-carboxylic acid methyl ester Methyl (5Z)-4-benzyl-3-oxo-5-phenyl-7,8-dihydro-1,4-thiazocine-7-carboxylate Methyl (5Z)-3-oxidanylidene-5-phenyl-4-(phenylmethyl)-7,8-dihydro-1,4-thiazocine-7-carboxylate
Wiley ID 1697286