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Benzyl 2(S)-[(tert-butoxycarbonyl)amino]-4-oxo-4-(4'-acetoxyphenyl)butanoate
SpectraBase Compound ID 1sObcqNtMK6
InChI InChI=1S/C24H27NO7/c1-16(26)31-19-12-10-18(11-13-19)21(27)14-20(25-23(29)32-24(2,3)4)22(28)30-15-17-8-6-5-7-9-17/h5-13,20H,14-15H2,1-4H3,(H,25,29)/t20-/m0/s1
InChIKey UIASYFNPGIJCKV-FQEVSTJZSA-N
Mol Weight 441.48 g/mol
Molecular Formula C24H27NO7
Exact Mass 441.178752 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7HOgFNy1sMm
Name Benzyl 2(S)-[(tert-butoxycarbonyl)amino]-4-oxo-4-(4'-acetoxyphenyl)butanoate
Alternate Name(s) benzyl (2S)-4-[4-(acetyloxy)phenyl]-2-[(tert-butoxycarbonyl)amino]-4-oxobutanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H27NO7
InChI InChI=1S/C24H27NO7/c1-16(26)31-19-12-10-18(11-13-19)21(27)14-20(25-23(29)32-24(2,3)4)22(28)30-15-17-8-6-5-7-9-17/h5-13,20H,14-15H2,1-4H3,(H,25,29)/t20-/m0/s1
InChIKey UIASYFNPGIJCKV-FQEVSTJZSA-N
Molecular Weight 441.480 g/mol
SMILES N([C@@](CC(c1ccc(OC(=O)C)cc1)=O)(C(OCc1ccccc1)=O)[H])C(OC(C)(C)C)=O
SPLASH splash10-0udr-0095000000-e470637bb5e556f89783
Source of Spectrum J-57-3402-17
Wiley ID 1385068