SpectraBase Spectrum ID |
5YXn8Dqqbey |
Name |
Phenylalanine methyl ester |
Classification |
Chemical |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
179.094628661 u |
Formula |
C10H13NO2 |
InChI |
InChI=1S/C10H13NO2/c1-13-10(12)7-9(11)8-5-3-2-4-6-8/h2-6,9H,7,11H2,1H3 |
InChIKey |
XKIOBYHZFPTKCZ-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
179.219 g/mol |
Nominal Mass |
179 u |
Quality |
970 |
Retention Index |
1362 |
SMILES |
NC(C1=CC=CC=C1)CC(OC)=O |
SPLASH |
splash10-0079-9300000000-4e17a867d2888eacb9cc |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
methyl 3-amino-3-phenylpropanoate |
Technique |
GC/MS |
Wiley ID |
DD2024_017947 |