| SpectraBase Spectrum ID |
5lTiyo2IPbS |
| Name |
2-(S-Methyl-S-p-tolyl)sulfoximidoyl-1-(m-tolyl)ethyl 2-iodobenzoate |
| Appearance |
Colorless viscous oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
533.052159808 u |
| Formula |
C24H24INO3S |
| InChI |
InChI=1S/C24H24INO3S/c1-17-11-13-20(14-12-17)30(3,28)26-16-23(19-8-6-7-18(2)15-19)29-24(27)21-9-4-5-10-22(21)25/h4-15,23H,16H2,1-3H3 |
| InChIKey |
LTTFPZGTCWIVKA-UHFFFAOYSA-N |
| Instrument Name |
Finnigan SSQ 7000 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201803975 |
| Molecular Weight |
533.424 g/mol |
| Quality |
63 |
| Reported Formula |
C24H24INO3S |
| SMILES |
C1=CC(=C(C=C1)I)C(=O)OC(CN=S(C)(C1=CC=C(C=C1)C)=O)C1=CC(=CC=C1)C |
| SPLASH |
splash10-001i-0900000000-dbba5dfce9f2d8d89e1f |
| Sample Comments |
dr = 65:35 |
| Source of Spectrum |
QE-24-SM7-6cc (DOI: 10.1002/chem.201803975) |
| Wiley ID |
1901730 |
