| SpectraBase Spectrum ID |
2Zk7wOxwZjH |
| Name |
2-acetamido-3-[4-(3-methylbut-2-enoxy)phenyl]propanoic acid |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H21NO4 |
| InChI |
InChI=1S/C16H21NO4/c1-11(2)8-9-21-14-6-4-13(5-7-14)10-15(16(19)20)17-12(3)18/h4-8,15H,9-10H2,1-3H3,(H,17,18)(H,19,20) |
| InChIKey |
YHKFAYFIUKFOFG-UHFFFAOYSA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np030044w |
| Molecular Weight |
291.347 g/mol |
| Optical Rotation |
[a]D25 = +42.5 (c = 1.46, MeOH) |
| Reported Formula |
C16H21NO4 |
| SMILES |
N(C(C(=O)O)Cc1ccc(cc1)OCC=C(C)C)C(=O)C |
| SPLASH |
splash10-0a4i-4900000000-2961d17c6fffa043125b |
| Source of Spectrum |
G4-66-1099-3 |
| Wiley ID |
1881478 |
![2-acetamido-3-[4-(3-methylbut-2-enoxy)phenyl]propionic acid](/api/spectrum/2Zk7wOxwZjH/structure.png?h=300&w=458 "2-acetamido-3-[4-(3-methylbut-2-enoxy)phenyl]propionic acid")
