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L-Phenylalanine, 2-(benzoylamino)-3-phenylpropyl ester, (S)-
SpectraBase Compound ID 7TCrfv85QZy
InChI InChI=1S/C25H26N2O3/c26-23(17-20-12-6-2-7-13-20)25(29)30-18-22(16-19-10-4-1-5-11-19)27-24(28)21-14-8-3-9-15-21/h1-15,22-23H,16-18,26H2,(H,27,28)/t22-,23-/m0/s1
InChIKey KSRWWRLJRFNOBF-GOTSBHOMSA-N
Mol Weight 402.49 g/mol
Molecular Formula C25H26N2O3
Exact Mass 402.194343 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8b4eSe4nrPa
Name L-Phenylalanine, 2-(benzoylamino)-3-phenylpropyl ester, (S)-
CAS Registry Number 70558-77-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H26N2O3
InChI InChI=1S/C25H26N2O3/c26-23(17-20-12-6-2-7-13-20)25(29)30-18-22(16-19-10-4-1-5-11-19)27-24(28)21-14-8-3-9-15-21/h1-15,22-23H,16-18,26H2,(H,27,28)/t22-,23-/m0/s1
InChIKey KSRWWRLJRFNOBF-GOTSBHOMSA-N
Molecular Weight 402.494 g/mol
SMILES N(C(=O)c1ccccc1)[C@](COC([C@](Cc1ccccc1)(N)[H])=O)(Cc1ccccc1)[H]
SPLASH splash10-0006-9800000000-3264a9d3269a6b3adc77
Source of Spectrum F-34-2793-95
Synonyms (2S)-2-(benzoylamino)-3-phenylpropyl (2S)-2-amino-3-phenylpropanoate L-Phenylalanine, 2-(benzoylamino)-3-phenylpropyl ester, (S)- N-Benzoxy-O-(L-phenylalanyl)-L-phenylalaninol
Wiley ID 1370543