SpectraBase Spectrum ID |
JnG1RZZc486 |
Name |
Phenylalanine, N-acetyl-.beta.-2-propynyl-, erythro- |
CAS Registry Number |
96688-76-5 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C14H15NO3 |
InChI |
InChI=1S/C14H15NO3/c1-3-7-12(11-8-5-4-6-9-11)13(14(17)18)15-10(2)16/h1,4-6,8-9,12-13H,7H2,2H3,(H,15,16)(H,17,18)/t12-,13+/m0/s1 |
InChIKey |
IFCFWWNIHMGXDQ-QWHCGFSZSA-N |
Molecular Weight |
245.278 g/mol |
SMILES |
OC([C@](NC(=O)C)([C@](c1ccccc1)(CC#C)[H])[H])=O |
SPLASH |
splash10-004i-1900000000-b4488798a4fd195e7009 |
Source of Spectrum |
J-50-2335-11 |
Synonyms |
(2R*,3S*)-2-acetamido-3-phenyl-5-hexynoic acid
(2R,3S)-2-(acetylamino)-3-phenyl-5-hexynoic acid |
Wiley ID |
1248022 |