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(2S,3S)-3-[(2-aminophenyl)thio]-2-hydroxy-3-(4-methoxyphenyl)propanoic acid tert-butyl ester
SpectraBase Compound ID F4ibEEJKB8N
InChI InChI=1S/C20H25NO4S/c1-20(2,3)25-19(23)17(22)18(13-9-11-14(24-4)12-10-13)26-16-8-6-5-7-15(16)21/h5-12,17-18,22H,21H2,1-4H3/t17-,18+/m1/s1
InChIKey ZNEVUPRZXQUMDG-MSOLQXFVSA-N
Mol Weight 375.48 g/mol
Molecular Formula C20H25NO4S
Exact Mass 375.150429 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LkonehII2wo
Name (2S,3S)-3-[(2-aminophenyl)thio]-2-hydroxy-3-(4-methoxyphenyl)propanoic acid tert-butyl ester
Alternate Name(s) (2S,3S)-3-[(2-aminophenyl)thio]-2-hydroxy-3-(4-methoxyphenyl)propionic acid tert-butyl ester tert-Butyl (2S,3S)-3-(2-aminophenyl)sulfanyl-3-(4-methoxyphenyl)-2-oxidanyl-propanoate
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Formula C20H25NO4S
InChI InChI=1S/C20H25NO4S/c1-20(2,3)25-19(23)17(22)18(13-9-11-14(24-4)12-10-13)26-16-8-6-5-7-15(16)21/h5-12,17-18,22H,21H2,1-4H3/t17-,18+/m1/s1
InChIKey ZNEVUPRZXQUMDG-MSOLQXFVSA-N
Molecular Weight 375.483 g/mol
SMILES Nc1c(S[C@]([C@](C(OC(C)(C)C)=O)(O)[H])(c2ccc(cc2)OC)[H])cccc1
SPLASH splash10-0ab9-6900000000-20d41b168228f75275db
Source of Spectrum KC-0-3504-14
Wiley ID 823904