| SpectraBase Spectrum ID |
6nLQ0vvHDgd |
| Name |
L-Isoleucine, N-neopentyloxycarbonyl-, hexadecyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
469.413109251 u |
| Formula |
C28H55NO4 |
| InChI |
InChI=1S/C28H55NO4/c1-7-9-10-11-12-13-14-15-16-17-18-19-20-21-22-32-26(30)25(24(3)8-2)29-27(31)33-23-28(4,5)6/h24-25H,7-23H2,1-6H3,(H,29,31) |
| InChIKey |
FMZZHIRUZYAVHF-UHFFFAOYSA-N |
| Molecular Weight |
469.751 g/mol |
| SMILES |
CCCCCCCCCCCCCCCCOC(C(NC(OCC(C)(C)C)=O)C(C)CC)=O |
