| SpectraBase Spectrum ID |
EssbyVelU5N |
| Name |
t-Butyl N-((S)-5-Methylhex-1-en-3-yl)-L-alaninate |
| Carrier Gas |
Hydrogen |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
241.204179111 u |
| Formula |
C14H27NO2 |
| GC Oven Program |
Oven temp 300oC |
| InChI |
InChI=1S/C14H27NO2/c1-8-12(9-10(2)3)15-11(4)13(16)17-14(5,6)7/h8,10-12,15H,1,9H2,2-7H3/t11-,12+/m0/s1 |
| InChIKey |
GJNYIVLOVIQNMK-NWDGAFQWSA-N |
| Instrument Name |
Agilent HP6890-5937 N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ejoc.202200188 |
| Molecular Weight |
241.375 g/mol |
| Optical Rotation |
[a]D20 = -96.9 (365 nm), -72.6 (436 nm),- 45.3 (546 nm), -39.9 (579 nm), 41.2 (589 nm) (c = 0.27 g/100 mL, CHCl3) |
| Quality |
134 |
| SMILES |
N([C@@](CC(C)C)(C=C)[H])[C@](C(OC(C)(C)C)=O)(C)[H] |
| SPLASH |
splash10-0006-4900000000-4cbde811070984cf6afc |
| Sample Comments |
>99% de |
| Source of Spectrum |
K1-2022-SM71-S,S-8d (DOI: 10.1002/ejoc.202200188) |
| Thin-Layer Chromatography |
0.39 (SiO2, CyHex/EtOAc, 5:1) |
| Wiley ID |
1898520 |
