| SpectraBase Spectrum ID |
L1cznB32MgL |
| Name |
tert-Butyl 2-(3-((2R,3S)-3-acetyloxiran-2-yl)propyl)-3-tert-butyldiphenylsiloxymethyl-1H-pyrrole-1-carboxylate |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
561.291050019 u |
| Formula |
C33H43NO5Si |
| InChI |
InChI=1S/C33H43NO5Si/c1-24(35)30-29(38-30)20-14-19-28-25(21-22-34(28)31(36)39-32(2,3)4)23-37-40(33(5,6)7,26-15-10-8-11-16-26)27-17-12-9-13-18-27/h8-13,15-18,21-22,29-30H,14,19-20,23H2,1-7H3/t29-,30-/m1/s1 |
| InChIKey |
MDCBQXYDEAHNBS-LOYHVIPDSA-N |
| Instrument Name |
Finnigan MAT 95 or API QSTAR PULSAR iLC/MS/TOF |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201711439 |
| Molecular Weight |
561.794 g/mol |
| Optical Rotation |
[a]D25.4 = -14.4o (c = 1.00, DCM) |
| Reported Formula |
C33H43NO5Si |
| SMILES |
C(OC(C)(C)C)(=O)N1C(=C(C=C1)CO[Si](C1=CC=CC=C1)(C1=CC=CC=C1)C(C)(C)C)CCC[C@@]1([C@@](C(C)=O)(O1)[H])[H] |
| SPLASH |
splash10-0002-0900000000-8f86c9b8ce81d772359e |
| Sample Comments |
98.5% ee |
| Source of Spectrum |
ACI-57-SM78-(-)-14 (DOI: 10.1002/anie.201711439) |
| Thin-Layer Chromatography |
0.27 (EtOAc/hexane, 10%), 0.48 (acetone/hexane, 15%) |
| Wiley ID |
1890639 |
