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S-(4"-Methylphenyl) (2'R,4S)-2'-(tert-butyloxycarbonyl)amino]-2'-(2,2-dimethyl-1,3-dioxolan-4-yl)ethanethioate
SpectraBase Compound ID 61S1Pb1ZIrB
InChI InChI=1S/C19H27NO5S/c1-13-7-9-14(10-8-13)26-16(21)11-20(17(22)25-18(2,3)4)15-12-23-19(5,6)24-15/h7-10,15H,11-12H2,1-6H3
InChIKey IXYQUNUXOSKBLW-UHFFFAOYSA-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 5FNyhvIJhJV
Name S-(4"-Methylphenyl) (2'R,4S)-2'-(tert-butyloxycarbonyl)amino]-2'-(2,2-dimethyl-1,3-dioxolan-4-yl)ethanethioate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H27NO5S
InChI InChI=1S/C19H27NO5S/c1-13-7-9-14(10-8-13)26-16(21)11-20(17(22)25-18(2,3)4)15-12-23-19(5,6)24-15/h7-10,15H,11-12H2,1-6H3
InChIKey IXYQUNUXOSKBLW-UHFFFAOYSA-N
Molecular Weight 381.487 g/mol
SMILES C(N(C1OC(C)(C)OC1)CC(Sc1ccc(cc1)C)=O)(OC(C)(C)C)=O
SPLASH splash10-00dl-8941000000-f44b956cabf9f468692c
Source of Spectrum J-60-6437-19
Synonyms S-(4''-Methylphenyl) (2'R,4S)-2'-(tert-butyloxycarbonyl)amino]-2'-(2,2-dimethyl-1,3-dioxolan-4-yl)ethanethioate S-(4-methylphenyl)[(tert-butoxycarbonyl)(2,2-dimethyl-1,3-dioxolan-4-yl)amino]ethanethioate
Wiley ID 1360135