| SpectraBase Spectrum ID |
6Hl33gwjPsO |
| Name |
1-((2S*,3R*)-3-(3-(1-methyl-1H-pyrrol-2-yl)propyl)oxiran-2-yl)ethan-1-one |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
207.125928789 u |
| Formula |
C12H17NO2 |
| InChI |
InChI=1S/C12H17NO2/c1-9(14)12-11(15-12)7-3-5-10-6-4-8-13(10)2/h4,6,8,11-12H,3,5,7H2,1-2H3/t11-,12-/m1/s1 |
| InChIKey |
DXSOAICMYFFNIE-VXGBXAGGSA-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 |
207.273 g/mol |
| Quality |
90 |
| Reported Formula |
C12H17NO2 |
| SMILES |
C([C@@]1([C@](O1)(CCCC1=CC=CN1C)[H])[H])(=O)C |
| SPLASH |
splash10-0006-9110000000-72ba36f2334e9c37749f |
| Source of Spectrum |
ACI-57-SM22-2f.3 (DOI: 10.1002/anie.201711439) |
| Thin-Layer Chromatography |
0.40 (acetone/hexane, 15%) |
| Wiley ID |
1890680 |
