PMG Verticillium dahliae metabolite library v.01 (Last update 21/06/2020)
Showing iCard for b-Alanine (3TMS) (PMG-VD000003)
|
Mass spectrum (Rel abundance vs m/z) |
|
|
Peaks |
( 73 553) ( 86 145) (100 102) (174 1000) (175 163) (248 992) (290 346) |
|
Average Retention time (min) |
19.66
|
|
Quant mass (Da) |
248
|
|
Common Name |
b-Alanine
|
|
Structure |
|
|
Synonym(s) |
β-Alanine; 3-Aminopropionate; 3-Aminopropanoic acid; 3-amino-Propanoate; 3-amino-Propanoic acid; beta-Aminopropionate; beta-Aminopropionic acid
|
|
KEGG ID |
|
|
Golm Metabolome Database ID |
A140001 |
|
PubChem CID |
239 |
|
CAS Registry Number |
107-95-9
|
|
Biosynthetic pathways (KEGG) |
map00240Pyrimidine metabolism map00410beta-Alanine metabolism map00640Propanoate metabolism map00770Pantothenate and CoA biosynthesis
|
|
Monoisotopic mass (Da) |
89.0477
|
|
Average Molecular Mass (Da) |
89.0932
|
|
Molecular Formula |
C3H7NO2
|
|
Chemical group |
Amino acids
|
|
Analyzer |
Agilent 6890 MS platform; 5973 series mass selective detector (MSD); 7683 autosampler
|
|
Carrier gas |
Helium |
|
Flow rate |
1 mL min-1
|
|
Column |
HP-5MS, length; 30 m, i.d.; 0.25 mm, film thickness 0.25 μm, Agilent Technologies Inc.
|
|
Ionization |
Electron Impact (EI), Positive
|
|
Mass range |
50-800 Da
|
|
Injector |
5:1 split mode; temperature of 230oC
|
|
Oven temperature |
70oC stable 5 min; 5oC min-1 increase to 295oC; stable 2 min
|
Curator(s): M. LYKOGIANNI, Dr KA ALIFERIS