SpectraBase Spectrum ID |
ExasqDBVjNP |
Name |
tert-butyl (2S)-2-[[(E)-5-methylhex-2-enyl]amino]propanoate |
Appearance |
Colorless oil |
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/c1-11(2)9-7-8-10-15-12(3)13(16)17-14(4,5)6/h7-8,11-12,15H,9-10H2,1-6H3/b8-7+/t12-/m0/s1 |
InChIKey |
JXNNHHMVMRLOAO-GUOLPTJISA-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 = 17.6 (436 nm), 10.9 (546 nm), 7.60 (579 nm), 0.91 (589 nm) (c = 0.16 g/100 mL, CHCl3) |
Quality |
82 |
SMILES |
N(C\C=C\CC(C)C)[C@@](C)(C(=O)OC(C)(C)C)[H] |
SPLASH |
splash10-0006-3900000000-577edea5039e22ce4009 |
Source of Spectrum |
K1-2022-SM72-E,S-11d (DOI: 10.1002/ejoc.202200188) |
Thin-Layer Chromatography |
0.15 (SiO2, CyHex/EtOAc, 5:1) |
Wiley ID |
1898503 |