| SpectraBase Spectrum ID |
1rQOTk8bCbp |
| Name |
t-Butyl N-((R)-Hex-1-en-3-yl)glycinate |
| Appearance |
Yellow oil |
| Carrier Gas |
Hydrogen |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
213.172878983 u |
| Formula |
C12H23NO2 |
| GC Oven Program |
Oven temp 300oC |
| InChI |
InChI=1S/C12H23NO2/c1-6-8-10(7-2)13-9-11(14)15-12(3,4)5/h7,10,13H,2,6,8-9H2,1,3-5H3/t10-/m0/s1 |
| InChIKey |
CJDGBXUCHZQETI-JTQLQIEISA-N |
| Instrument Name |
Agilent HP6890-5937 N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ejoc.202200188 |
| Molecular Weight |
213.321 g/mol |
| Optical Rotation |
[a]D20 = -5.0 (365 nm), -5.0 (436 nm), -0.2 (546 nm), -0.2 (579 nm), -0.2 (589 nm) (c = 0.58 g/100 mL, CHCl3) |
| Quality |
149 |
| SMILES |
N([C@](CCC)(C=C)[H])CC(=O)OC(C)(C)C |
| SPLASH |
splash10-08fu-9600000000-ee855109cfe3e902bf91 |
| Sample Comments |
91% ee |
| Source of Spectrum |
K1-2022-SM80-R-8b (DOI: 10.1002/ejoc.202200188) |
| Thin-Layer Chromatography |
0.18 (SiO2, CyHex/EtOAc, 5:1) |
| Wiley ID |
1898513 |
