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Alaninamide, N-[(phenylmethoxy)carbonyl]-L-phenylalanyl-N,N,2-trimethyl-
SpectraBase Compound ID G5fuAK08fS4
InChI InChI=1S/C23H29N3O4/c1-23(2,21(28)26(3)4)25-20(27)19(15-17-11-7-5-8-12-17)24-22(29)30-16-18-13-9-6-10-14-18/h5-14,19H,15-16H2,1-4H3,(H,24,29)(H,25,27)/t19-/m0/s1
InChIKey ZIUISVHPUUAEQI-IBGZPJMESA-N
Mol Weight 411.5 g/mol
Molecular Formula C23H29N3O4
Exact Mass 411.215806 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GjW43goKzyG
Name Alaninamide, N-[(phenylmethoxy)carbonyl]-L-phenylalanyl-N,N,2-trimethyl-
CAS Registry Number 111492-20-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H29N3O4
InChI InChI=1S/C23H29N3O4/c1-23(2,21(28)26(3)4)25-20(27)19(15-17-11-7-5-8-12-17)24-22(29)30-16-18-13-9-6-10-14-18/h5-14,19H,15-16H2,1-4H3,(H,24,29)(H,25,27)/t19-/m0/s1
InChIKey ZIUISVHPUUAEQI-IBGZPJMESA-N
Molecular Weight 411.502 g/mol
SMILES N(C([C@@](NC(=O)OCc1ccccc1)(Cc1ccccc1)[H])=O)C(C(N(C)C)=O)(C)C
SPLASH splash10-0596-9300000000-19a316afeb6682287773
Source of Spectrum H-70-363-9
Synonyms 2-[n2-(benzyloxycarbonyl)phenylalaninamido]-N,N,2-trimethylpropionamide benzyl (1S)-1-benzyl-2-{[2-(dimethylamino)-1,1-dimethyl-2-oxoethyl]amino}-2-oxoethylcarbamate N-Benzyloxycarbonyl-L-phenylalanyl-N(1),n(1),2-trimethylalanin-amide
Wiley ID 1374124