| SpectraBase Spectrum ID |
6BqBlGAsLIr |
| Name |
L-Phenylalanine, N-methyl-N-(N-propyloxycarbonyl)-, N-propyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
307.178358285 u |
| Formula |
C17H25NO4 |
| InChI |
InChI=1S/C17H25NO4/c1-4-11-21-16(19)15(13-14-9-7-6-8-10-14)18(3)17(20)22-12-5-2/h6-10,15H,4-5,11-13H2,1-3H3 |
| InChIKey |
SWJYZVWVKFVAOJ-UHFFFAOYSA-N |
| Molecular Weight |
307.390 g/mol |
| SMILES |
C1(=CC=CC=C1)CC(C(OCCC)=O)N(C)C(OCCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.96489 |
