| SpectraBase Spectrum ID |
DaBA3BLJaST |
| Name |
(E)-4-((E)-1-(4-Methoxyphenyl)-3-phenylallylidene)-1-tosylpyrrolidin-3-ol |
| Appearance |
Brown oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
461.166079523 u |
| Formula |
C27H27NO4S |
| InChI |
InChI=1S/C27H27NO4S/c1-20-8-15-24(16-9-20)33(30,31)28-18-26(27(29)19-28)25(17-10-21-6-4-3-5-7-21)22-11-13-23(32-2)14-12-22/h3-17,27,29H,18-19H2,1-2H3/b17-10+,26-25+ |
| InChIKey |
IVVOVVPIJMDBSN-IZMCYLEISA-N |
| Instrument Name |
LRMS |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.202203068 |
| Molecular Weight |
461.576 g/mol |
| Reported Formula |
C27H27NO4S |
| SMILES |
OC1\C(CN(C1)S(C1=CC=C(C=C1)C)(=O)=O)=C\(C1=CC=C(C=C1)OC)\C=C\C1=CC=CC=C1 |
| SPLASH |
splash10-0006-0001900000-c035f16dd5476ae251f0 |
| Source of Spectrum |
QE-29-SM36-4jb (DOI: 10.1002/chem.202203068) |
| Thin-Layer Chromatography |
0.40 (33% EtOAc/toluene) |
| Wiley ID |
1909458 |
