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S-(4"-Methylphenyl) (2'R,4S)-2'-(benzyloxycarbonyl)amino]-2'-(2,2-dimethyl-1,3-dioxolan-4-yl)ethanethioate

View entire compound with spectra: 1 MS (GC)

S-(4"-Methylphenyl) (2'R,4S)-2'-(benzyloxycarbonyl)amino]-2'-(2,2-dimethyl-1,3-dioxolan-4-yl)ethanethioate
SpectraBase Compound ID JiuAdjJAn62
InChI InChI=1S/C22H25NO5S/c1-15-9-11-17(12-10-15)29-20(24)19(18-14-27-22(2,3)28-18)23-21(25)26-13-16-7-5-4-6-8-16/h4-12,18-19H,13-14H2,1-3H3,(H,23,25)/t18-,19-/m1/s1
InChIKey OZBFEOBDWWULDV-RTBURBONSA-N
Mol Weight 415.5 g/mol
Molecular Formula C22H25NO5S
Exact Mass 415.145344 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7PU9FwxJkop
Name S-(4"-Methylphenyl) (2'R,4S)-2'-(benzyloxycarbonyl)amino]-2'-(2,2-dimethyl-1,3-dioxolan-4-yl)ethanethioate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H25NO5S
InChI InChI=1S/C22H25NO5S/c1-15-9-11-17(12-10-15)29-20(24)19(18-14-27-22(2,3)28-18)23-21(25)26-13-16-7-5-4-6-8-16/h4-12,18-19H,13-14H2,1-3H3,(H,23,25)/t18-,19-/m1/s1
InChIKey OZBFEOBDWWULDV-RTBURBONSA-N
Molecular Weight 415.504 g/mol
SMILES N([C@@](C(Sc1ccc(cc1)C)=O)([C@@]1(OC(C)(C)OC1)[H])[H])C(=O)OCc1ccccc1
SPLASH splash10-0006-9310200000-b2273ea9b667dfd8993b
Source of Spectrum J-60-6437-20
Synonyms S-(4-methylphenyl) (2R)-{[(benzyloxy)carbonyl]amino}[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]ethanethioate S-(4-Methylphenyl) (2R,4S)-2-[(benzyloxycarbonyl)amino]-2-(2,2-dimethyl-1,3-dioxolan-4-yl)ethanethioate
Wiley ID 1375971