SpectraBase Spectrum ID |
8KTJ4NTHI1s |
Name |
(E/Z)-3-((2,4-difluorophenyl)(triethylsilyl)methylene)-1-((4-methoxyphenyl)sulfonyl)-1,2,3,5,6,6a-hexahydrocyclopenta[b]pyrrole |
Appearance |
Yellow crystalline solid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
517.191847959 u |
Formula |
C27H33F2NO3SSi |
InChI |
InChI=1S/C27H33F2NO3SSi/c1-5-35(6-2,7-3)27(23-16-11-19(28)17-25(23)29)24-18-30(26-10-8-9-22(24)26)34(31,32)21-14-12-20(33-4)13-15-21/h9,11-17,26H,5-8,10,18H2,1-4H3 |
InChIKey |
PTACQDKYJSROLW-UHFFFAOYSA-N |
Instrument Name |
LTQ Orbitrap XL or Shimadzu QP 2010 |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/chem.201802493 |
Molecular Weight |
517.707 g/mol |
Reported Formula |
C27H33F2NO3SSi |
SMILES |
CC[Si](CC)(CC)C(=C1CN(S(C=2C=CC(=CC2)OC)(=O)=O)C2C1=CCC2)C1=CC=C(C=C1F)F |
SPLASH |
splash10-014i-0020090000-cc869ac2f9dc1726c280 |
Sample Comments |
Mixture of E/Z |
Source of Spectrum |
QE-24-SM20-5f (DOI: 10.1002/chem.201802493) |
Wiley ID |
1901611 |