| SpectraBase Spectrum ID |
8IDekHEMCTw |
| Name |
L-Phenylalanine AC ME |
| Classification |
Amino acid derivative |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
221.105193344 u |
| Formula |
C12H15NO3 |
| InChI |
InChI=1S/C12H15NO3/c1-9(14)13-11(12(15)16-2)8-10-6-4-3-5-7-10/h3-7,11H,8H2,1-2H3,(H,13,14)/t11-/m0/s1 |
| InChIKey |
IKGHIFGXPVLPFD-NSHDSACASA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
221.256 g/mol |
| Nominal Mass |
221 u |
| Quality |
836 |
| Retention Index |
1652 |
| SMILES |
[C@](NC(=O)C)(C(OC)=O)(CC1=CC=CC=C1)[H] |
| SPLASH |
splash10-03du-8900000000-cd68f1da3a977de12489 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Methyl (2S)-2-(acetylamino)-3-phenyl propanoate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_031709 |
