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L-Alanine, N-(1-acetyl-L-prolyl)-, phenylmethyl ester
SpectraBase Compound ID 1lGwI6aNp35
InChI InChI=1S/C17H22N2O4/c1-12(17(22)23-11-14-7-4-3-5-8-14)18-16(21)15-9-6-10-19(15)13(2)20/h3-5,7-8,12,15H,6,9-11H2,1-2H3,(H,18,21)/t12-,15-/m0/s1
InChIKey CHGOZIMPHMHKMA-WFASDCNBSA-N
Mol Weight 318.37 g/mol
Molecular Formula C17H22N2O4
Exact Mass 318.157957 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 65sCUmAXyVk
Name L-Alanine, N-(1-acetyl-L-prolyl)-, phenylmethyl ester
Alternate Name(s) benzyl (2S)-2-({[(2S)-1-acetylpyrrolidinyl]carbonyl}amino)propanoate N-(N'-acetyl-L-prolyl)-L-alanine benzyl ester
CAS Registry Number 74214-36-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22N2O4
InChI InChI=1S/C17H22N2O4/c1-12(17(22)23-11-14-7-4-3-5-8-14)18-16(21)15-9-6-10-19(15)13(2)20/h3-5,7-8,12,15H,6,9-11H2,1-2H3,(H,18,21)/t12-,15-/m0/s1
InChIKey CHGOZIMPHMHKMA-WFASDCNBSA-N
Molecular Weight 318.373 g/mol
SMILES N(C([C@]1(N(C(=O)C)CCC1)[H])=O)[C@](C(OCc1ccccc1)=O)(C)[H]
SPLASH splash10-022c-8900000000-672b7e21892ebf4dacec
Source of Spectrum KC-1990-3106-5
Wiley ID 1318429