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Phenylalanine, N-benzoyl-.beta.-2-propynyl-, erythro-
SpectraBase Compound ID 4DH4t9RhFMF
InChI InChI=1S/C19H17NO3/c1-2-9-16(14-10-5-3-6-11-14)17(19(22)23)20-18(21)15-12-7-4-8-13-15/h1,3-8,10-13,16-17H,9H2,(H,20,21)(H,22,23)/t16-,17+/m0/s1
InChIKey DPBBULFJUGJWLC-DLBZAZTESA-N
Mol Weight 307.35 g/mol
Molecular Formula C19H17NO3
Exact Mass 307.120843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5hlR4EFECWA
Name Phenylalanine, N-benzoyl-.beta.-2-propynyl-, erythro-
CAS Registry Number 96666-72-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H17NO3
InChI InChI=1S/C19H17NO3/c1-2-9-16(14-10-5-3-6-11-14)17(19(22)23)20-18(21)15-12-7-4-8-13-15/h1,3-8,10-13,16-17H,9H2,(H,20,21)(H,22,23)/t16-,17+/m0/s1
InChIKey DPBBULFJUGJWLC-DLBZAZTESA-N
Molecular Weight 307.349 g/mol
SMILES N([C@@](C(=O)O)([C@](c1ccccc1)(CC#C)[H])[H])C(=O)c1ccccc1
SPLASH splash10-056r-3900000000-726489f59dfeeeed7b2b
Source of Spectrum J-50-2336-12
Synonyms (2R*,3S*)-2-benzamido-3-phenyl-5-hexynoic acid (2R,3S)-2-(benzoylamino)-3-phenyl-5-hexynoic acid
Wiley ID 1309107