| SpectraBase Spectrum ID |
KhvFSzCNJAf |
| Name |
L-Leucine, N-neopentyloxycarbonyl-N-methyl-, isohexyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
343.272258671 u |
| Formula |
C19H37NO4 |
| InChI |
InChI=1S/C19H37NO4/c1-14(2)10-9-11-23-17(21)16(12-15(3)4)20(8)18(22)24-13-19(5,6)7/h14-16H,9-13H2,1-8H3 |
| InChIKey |
FVMCSSMKMYAECS-UHFFFAOYSA-N |
| Molecular Weight |
343.508 g/mol |
| SMILES |
CC(COC(N(C(C(OCCCC(C)C)=O)CC(C)C)C)=O)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.962994 |
