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Alanine, N-[N-(N-carboxyglycyl)-L-leucyl]-3-phenyl-, dimethyl ester, L-
SpectraBase Compound ID 9jwpQqROWIf
InChI InChI=1S/C20H29N3O6/c1-13(2)10-15(22-17(24)12-21-20(27)28)18(25)23(3)16(19(26)29-4)11-14-8-6-5-7-9-14/h5-9,13,15-16,21H,10-12H2,1-4H3,(H,22,24)(H,27,28)
InChIKey BKMQYIZCTLKVFY-UHFFFAOYSA-N
Mol Weight 407.47 g/mol
Molecular Formula C20H29N3O6
Exact Mass 407.205636 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lh1bVCilWAj
Name Alanine, N-[N-(N-carboxyglycyl)-L-leucyl]-3-phenyl-, dimethyl ester, L-
CAS Registry Number 25159-31-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H29N3O6
InChI InChI=1S/C20H29N3O6/c1-13(2)10-15(22-17(24)12-21-20(27)28)18(25)23(3)16(19(26)29-4)11-14-8-6-5-7-9-14/h5-9,13,15-16,21H,10-12H2,1-4H3,(H,22,24)(H,27,28)
InChIKey BKMQYIZCTLKVFY-UHFFFAOYSA-N
Molecular Weight 407.467 g/mol
SMILES N(C(CC(C)C)C(N(C)C(Cc1ccccc1)C(=O)OC)=O)C(CNC(O)=O)=O
SPLASH splash10-000i-9620000000-4faa7b3c3bf12bc6ecc8
Source of Spectrum O-2-797-1
Synonyms 2-[(1-([(1-Benzyl-2-methoxy-2-oxoethyl)(methyl)amino]carbonyl)-3-methylbutyl)amino]-2-oxoethylcarbamic acid [2-[[1-[(1-benzyl-2-keto-2-methoxy-ethyl)-methyl-carbamoyl]-3-methyl-butyl]amino]-2-keto-ethyl]carbamic acid [2-[[1-[(1-benzyl-2-methoxy-2-oxo-ethyl)-methyl-carbamoyl]-3-methyl-butyl]amino]-2-oxo-ethyl]carbamic acid [2-[[1-[(1-methoxy-1-oxidanylidene-3-phenyl-propan-2-yl)-methyl-amino]-4-methyl-1-oxidanylidene-pentan-2-yl]amino]-2-oxidanylidene-ethyl]carbamic acid [2-[[1-[(1-methoxy-1-oxo-3-phenylpropan-2-yl)-methylamino]-4-methyl-1-oxopentan-2-yl]amino]-2-oxoethyl]carbamic acid
Wiley ID 1372538