| SpectraBase Spectrum ID |
36vhliW2cKF |
| Name |
L-Norleucine, N-neopentyloxycarbonyl-, dodecyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
413.350508993 u |
| Formula |
C24H47NO4 |
| InChI |
InChI=1S/C24H47NO4/c1-6-8-10-11-12-13-14-15-16-17-19-28-22(26)21(18-9-7-2)25-23(27)29-20-24(3,4)5/h21H,6-20H2,1-5H3,(H,25,27) |
| InChIKey |
PRRCYTNDAWTELX-UHFFFAOYSA-N |
| Molecular Weight |
413.643 g/mol |
| SMILES |
C(C(NC(OCC(C)(C)C)=O)CCCC)(OCCCCCCCCCCCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.863739 |
