| SpectraBase Spectrum ID |
3f9WxNUSvY |
| Name |
L-(2R,3R)-4-[(3-benzylcarbamoyl-2,3-dihydroxy-propionamido)methyl]-benzoic acid methyl ester |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H22N2O6 |
| InChI |
InChI=1S/C20H22N2O6/c1-28-20(27)15-9-7-14(8-10-15)12-22-19(26)17(24)16(23)18(25)21-11-13-5-3-2-4-6-13/h2-10,16-17,23-24H,11-12H2,1H3,(H,21,25)(H,22,26)/t16-,17-/m1/s1 |
| InChIKey |
CRHJNAPYKIFSMO-IAGOWNOFSA-N |
| Instrument Name |
Micromass ZabSpec |
| Ionization Type |
EI |
| Molecular Weight |
386.404 g/mol |
| Optical Rotation |
[a]D20 = +90.4 (20mg/2ml, CH3OH) |
| Reported Formula |
C20H22N2O6 |
| SMILES |
N(Cc1ccc(C(=O)OC)cc1)C([C@@]([C@](C(NCc1ccccc1)=O)(O)[H])(O)[H])=O |
| SPLASH |
splash10-0006-9803000000-fa29232cecc4723ef2e6 |
| Source of Spectrum |
CN101209976B |
| Wiley ID |
1844543 |
![L-(2R,3R)-4-[(3-benzylcarbamoyl-2,3-dihydroxy-propionamido)methyl]-benzoic acid methyl ester](/api/spectrum/3f9WxNUSvY/structure.png?h=300&w=458 "L-(2R,3R)-4-[(3-benzylcarbamoyl-2,3-dihydroxy-propionamido)methyl]-benzoic acid methyl ester")
