| SpectraBase Spectrum ID |
LuWPm5zkExb |
| Name |
(3S,4S)-tert-Butyl 4-((benzyloxycarbonyl)(methyl)amino)-3-hydroxy-5-methylhexanoate |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H31NO5 |
| InChI |
InChI=1S/C20H31NO5/c1-14(2)18(16(22)12-17(23)26-20(3,4)5)21(6)19(24)25-13-15-10-8-7-9-11-15/h7-11,14,16,18,22H,12-13H2,1-6H3/t16-,18-/m0/s1 |
| InChIKey |
ULNILUAFROKCIO-WMZOPIPTSA-N |
| Instrument Name |
Finnigan MAT 95 XLT or Thermofinnigan MAT95 XL or Agilent 6890-5975b |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3762/bjoc.10.29 |
| Molecular Weight |
365.470 g/mol |
| Optical Rotation |
[a]D26.8 = -55.2 (c = 1.45, CHCl3) |
| Reported Formula |
C20H31NO5 |
| SMILES |
O[C@]([C@@](N(C)C(=O)OCc1ccccc1)(C(C)C)[H])(CC(OC(C)(C)C)=O)[H] |
| SPLASH |
splash10-052f-6910000000-1c67c8c3802f98ce1901 |
| Source of Spectrum |
BJO-10-SM4-(3S,4S)-6 |
| Thin-Layer Chromatography |
Rf = 0.22 (PE/acetone, 10:1) |
| Wiley ID |
1854048 |
