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(2R,2'S,4R,5R)-dimethyl 2-(t-butyl)-5-(2'-hydroxy-2'(S)-phenylethyl)-1,3-thiazolidine-3,4-dicarboxylate
SpectraBase Compound ID K71yxH9nzn2
InChI InChI=1S/C19H27NO5S/c1-19(2,3)17-20(18(23)25-5)15(16(22)24-4)14(26-17)11-13(21)12-9-7-6-8-10-12/h6-10,13-15,17,21H,11H2,1-5H3/t13-,14+,15-,17+/m0/s1
InChIKey NSUPWMGWKXZKGV-QSJFSLAZSA-N
Mol Weight 381.49 g/mol
Molecular Formula C19H27NO5S
Exact Mass 381.160994 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JKnTXBhLVTn
Name (2R,2'S,4R,5R)-dimethyl 2-(t-butyl)-5-(2'-hydroxy-2'(S)-phenylethyl)-1,3-thiazolidine-3,4-dicarboxylate
Alternate Name(s) Dimethyl (2R,4R,5R)-2-tert-butyl-5-[(2S)-2-hydroxy-2-phenylethyl]-1,3-thiazolidine-3,4-dicarboxylate
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Formula C19H27NO5S
InChI InChI=1S/C19H27NO5S/c1-19(2,3)17-20(18(23)25-5)15(16(22)24-4)14(26-17)11-13(21)12-9-7-6-8-10-12/h6-10,13-15,17,21H,11H2,1-5H3/t13-,14+,15-,17+/m0/s1
InChIKey NSUPWMGWKXZKGV-QSJFSLAZSA-N
Molecular Weight 381.487 g/mol
SMILES O[C@@](C[C@@]1([C@](N([C@](S1)(C(C)(C)C)[H])C(=O)OC)(C(=O)OC)[H])[H])(c1ccccc1)[H]
SPLASH splash10-056r-8911000000-856aa682c7fb1aa917cc
Source of Spectrum KC-1991-2296-13
Wiley ID 1360134