| SpectraBase Spectrum ID |
92GGDMZD2VZ |
| Name |
N-Acetyl-N-allylglycine-phenylalanine - methyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
415.210721041 u |
| Formula |
C22H29N3O5 |
| InChI |
InChI=1S/C22H29N3O5/c1-5-12-24(17(3)26)16-21(28)25(13-6-2)15-20(27)23-19(22(29)30-4)14-18-10-8-7-9-11-18/h5-11,19H,1-2,12-16H2,3-4H3,(H,23,27)/t19-/m0/s1 |
| InChIKey |
VRCHSWBWVLJZCQ-IBGZPJMESA-N |
| Molecular Weight |
415.490 g/mol |
| SMILES |
C(N(CC(N[C@](C(=O)OC)(CC1=CC=CC=C1)[H])=O)CC=C)(CN(C(=O)C)CC=C)=O |
