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(2R)-2-benzamido-2-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]ethanethioic acid S-(4-methylphenyl) ester
SpectraBase Compound ID 4jzDUwPZcYj
InChI InChI=1S/C21H23NO4S/c1-14-9-11-16(12-10-14)27-20(24)18(17-13-25-21(2,3)26-17)22-19(23)15-7-5-4-6-8-15/h4-12,17-18H,13H2,1-3H3,(H,22,23)/t17-,18-/m1/s1
InChIKey HKZHROIGLRNAHN-QZTJIDSGSA-N
Mol Weight 385.48 g/mol
Molecular Formula C21H23NO4S
Exact Mass 385.134779 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E12sYN5OKSR
Name (2R)-2-benzamido-2-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]ethanethioic acid S-(4-methylphenyl) ester
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Formula C21H23NO4S
InChI InChI=1S/C21H23NO4S/c1-14-9-11-16(12-10-14)27-20(24)18(17-13-25-21(2,3)26-17)22-19(23)15-7-5-4-6-8-15/h4-12,17-18H,13H2,1-3H3,(H,22,23)/t17-,18-/m1/s1
InChIKey HKZHROIGLRNAHN-QZTJIDSGSA-N
Molecular Weight 385.478 g/mol
SMILES N([C@@](C(Sc1ccc(cc1)C)=O)([C@@]1(OC(C)(C)OC1)[H])[H])C(=O)c1ccccc1
SPLASH splash10-0a6r-5921000000-c2da066c2eece8ea1eeb
Source of Spectrum J-60-6437-21
Synonyms (2R)-2-benzamido-2-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]ethanethioic acid S-(p-tolyl) ester S-(4-methylphenyl) (2R)-2-benzamido-2-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]ethanethioate S-(p-tolyl) (2R)-2-benzamido-2-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]ethanethioate
Wiley ID 1362207