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Pentanoic acid, 5-[[2-(1,1-dimethylethoxy)-1-methyl-2-oxoethyl]amino]-5-oxo-3-[[(phenylmethoxy)carbonyl]amino]-, 1,1-dimethylethyl ester, [R-(R*,S*)]-
SpectraBase Compound ID I4aOnDDplbA
InChI InChI=1S/C24H36N2O7/c1-16(21(29)33-24(5,6)7)25-19(27)13-18(14-20(28)32-23(2,3)4)26-22(30)31-15-17-11-9-8-10-12-17/h8-12,16,18H,13-15H2,1-7H3,(H,25,27)(H,26,30)/t16-,18+/m1/s1
InChIKey DQJPTUCOBOQREQ-AEFFLSMTSA-N
Mol Weight 464.6 g/mol
Molecular Formula C24H36N2O7
Exact Mass 464.252252 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID khpgryfQHb
Name Pentanoic acid, 5-[[2-(1,1-dimethylethoxy)-1-methyl-2-oxoethyl]amino]-5-oxo-3-[[(phenylmethoxy)carbonyl]amino]-, 1,1-dimethylethyl ester, [R-(R*,S*)]-
Alternate Name(s) (3R)-3-benzyloxycarbonylaminoglutaryl-(S)-alanine di-t-butyl ester tert-Butyl (3S)-3-{[(benzyloxy)carbonyl]amino}-5-{[(1R)-2-tert-butoxy-1-methyl-2-oxoethyl]amino}-5-oxopentanoate
CAS Registry Number 130737-76-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H36N2O7
InChI InChI=1S/C24H36N2O7/c1-16(21(29)33-24(5,6)7)25-19(27)13-18(14-20(28)32-23(2,3)4)26-22(30)31-15-17-11-9-8-10-12-17/h8-12,16,18H,13-15H2,1-7H3,(H,25,27)(H,26,30)/t16-,18+/m1/s1
InChIKey DQJPTUCOBOQREQ-AEFFLSMTSA-N
Molecular Weight 464.559 g/mol
SMILES N(C(C[C@@](CC(OC(C)(C)C)=O)(NC(=O)OCc1ccccc1)[H])=O)[C@@](C(OC(C)(C)C)=O)(C)[H]
SPLASH splash10-0a4l-9100000000-999e08edb8be224fc57d
Source of Spectrum KC-1990-2368-12
Wiley ID 1391467