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L-Alanine, N-[N-[(phenylmethoxy)carbonyl]-L-valyl]-, phenyl ester
SpectraBase Compound ID 5okmHYlULyo
InChI InChI=1S/C22H26N2O5/c1-15(2)19(24-22(27)28-14-17-10-6-4-7-11-17)20(25)23-16(3)21(26)29-18-12-8-5-9-13-18/h4-13,15-16,19H,14H2,1-3H3,(H,23,25)(H,24,27)/t16-,19-/m0/s1
InChIKey HHFFPZFHXUGRCM-LPHOPBHVSA-N
Mol Weight 398.46 g/mol
Molecular Formula C22H26N2O5
Exact Mass 398.184172 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AAaeHlLzmCz
Name L-Alanine, N-[N-[(phenylmethoxy)carbonyl]-L-valyl]-, phenyl ester
Alternate Name(s) N(.alpha)-benzyloxycarbonylvalylanine phenyl ester phenyl (2S)-2-[((2S)-2-{[(benzyloxy)carbonyl]amino}-3-methylbutanoyl)amino]propanoate
CAS Registry Number 73144-18-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H26N2O5
InChI InChI=1S/C22H26N2O5/c1-15(2)19(24-22(27)28-14-17-10-6-4-7-11-17)20(25)23-16(3)21(26)29-18-12-8-5-9-13-18/h4-13,15-16,19H,14H2,1-3H3,(H,23,25)(H,24,27)/t16-,19-/m0/s1
InChIKey HHFFPZFHXUGRCM-LPHOPBHVSA-N
Molecular Weight 398.459 g/mol
SMILES N(C([C@@](NC(=O)OCc1ccccc1)(C(C)C)[H])=O)[C@](C(Oc1ccccc1)=O)(C)[H]
SPLASH splash10-0006-9301000000-83f7a729e673119863a3
Source of Spectrum KC-1985-465-0
Wiley ID 1368428