| SpectraBase Spectrum ID |
9E9AdxNaf7e |
| Name |
(S)-Di-tert-butyl 2-((R,E)-hept-4-en-3-ylamino)glutarate |
| Appearance |
Yellow oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H37NO4 |
| InChI |
InChI=1S/C20H37NO4/c1-9-11-12-15(10-2)21-16(18(23)25-20(6,7)8)13-14-17(22)24-19(3,4)5/h11-12,15-16,21H,9-10,13-14H2,1-8H3/b12-11+/t15-,16+/m1/s1 |
| InChIKey |
XNQOJMTYWLWOFU-OEPMCUGXSA-N |
| Instrument Name |
Agilent 6890-5937 N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.202000307 |
| Molecular Weight |
355.519 g/mol |
| Optical Rotation |
[a]D20 = -17.4 (436 nm), -10.3 (546 nm), -8.2 (579 nm), -7.2 (589 nm) (c = 0.510 g/100 ml, CHCl3) |
| SMILES |
N([C@@](\C=C\CC)(CC)[H])[C@@](CCC(=O)OC(C)(C)C)(C(=O)OC(C)(C)C)[H] |
| SPLASH |
splash10-0pba-9630000000-cc3a04bdf5255a8ac313 |
| Sample Comments |
dr > 99:1 |
| Source of Spectrum |
QE-26-SM22-(R,S)-3i |
| Thin-Layer Chromatography |
Rf = 0.21 (Silica, cHex/EtOAc, 10:1) |
| Wiley ID |
1858582 |
