| SpectraBase Spectrum ID |
PO8R6PJyuS |
| Name |
val-leu, N-(Methoxycarbonyl)-, methyl ester (isomer 1) |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
302.184171940 u |
| Formula |
C14H26N2O5 |
| InChI |
InChI=1S/C14H26N2O5/c1-8(2)7-10(13(18)20-5)15-12(17)11(9(3)4)16-14(19)21-6/h8-11H,7H2,1-6H3,(H,15,17)(H,16,19) |
| InChIKey |
VZHJCXVNYBAYRF-UHFFFAOYSA-N |
| Molecular Weight |
302.371 g/mol |
| SMILES |
C(NC(C(=O)OC)CC(C)C)(C(NC(OC)=O)C(C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.930886 |
