SpectraBase Spectrum ID |
41Ny7zc9nFH |
Name |
(2S,3R)-tert-Butyl 2-(3-(3-acetyloxiran-2-yl)propyl)-5-ethyl-1H-pyrrole-1-carboxylate |
Appearance |
Pale yellow oil |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
321.194008349 u |
Formula |
C18H27NO4 |
InChI |
InChI=1S/C18H27NO4/c1-6-13-10-11-14(19(13)17(21)23-18(3,4)5)8-7-9-15-16(22-15)12(2)20/h10-11,15-16H,6-9H2,1-5H3/t15-,16-/m1/s1 |
InChIKey |
AYLKULANCUJORT-HZPDHXFCSA-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 |
321.417 g/mol |
Quality |
70 |
Reported Formula |
C18H27NO4 |
SMILES |
C([C@@]1([C@](O1)(CCCC1=CC=C(N1C(OC(C)(C)C)=O)CC)[H])[H])(C)=O |
SPLASH |
splash10-0a4j-0910000000-1f2b06e72e1c80a9a02f |
Source of Spectrum |
ACI-57-SM44-2j.5 (DOI: 10.1002/anie.201711439) |
Thin-Layer Chromatography |
0.20 (EtOAc/hexane, 5%) |
Wiley ID |
1890696 |