| SpectraBase Spectrum ID |
GIyO6gC9xXq |
| Name |
dl-Alanine, N-[[3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridinyl]methylene]-, methyl ester, (E)- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
252.111006999 u |
| Formula |
C12H16N2O4 |
| InChI |
InChI=1S/C12H16N2O4/c1-7-11(16)10(9(6-15)4-13-7)5-14-8(2)12(17)18-3/h4-5,8,15-16H,6H2,1-3H3/b14-5+ |
| InChIKey |
MUXCFJDZNNVQRU-LHHJGKSTSA-N |
| Molecular Weight |
252.270 g/mol |
| SMILES |
C1(\C=N\C(C(=O)OC)C)=C(C(C)=NC=C1CO)O |
![dl-Alanine, N-[[3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridinyl]methylene]-, methyl ester, (E)-](/api/spectrum/GIyO6gC9xXq/structure.png?h=300&w=458 "dl-Alanine, N-[[3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridinyl]methylene]-, methyl ester, (E)-")
