| SpectraBase Spectrum ID |
D4vorR66B7V |
| Name |
2-(S-Methyl-S-phenyl)sulfoximidoyl-1-(mesityl)ethyl 2-iodobenzoate |
| Appearance |
Colorless viscous oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
547.067809872 u |
| Formula |
C25H26INO3S |
| InChI |
InChI=1S/C25H26INO3S/c1-17-14-18(2)24(19(3)15-17)23(30-25(28)21-12-8-9-13-22(21)26)16-27-31(4,29)20-10-6-5-7-11-20/h5-15,23H,16H2,1-4H3 |
| InChIKey |
OOLYUJAVAOWRGU-UHFFFAOYSA-N |
| Instrument Name |
Finnigan SSQ 7000 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201803975 |
| Molecular Weight |
547.451 g/mol |
| Quality |
61 |
| Reported Formula |
C25H26INO3S |
| SMILES |
C(OC(C1=C(C=CC=C1)I)=O)(CN=S(C)(C1=CC=CC=C1)=O)C1=C(C=C(C=C1C)C)C |
| SPLASH |
splash10-00kf-1930000000-ecc8cda9eefb63b01b72 |
| Sample Comments |
dr = 74:26 |
| Source of Spectrum |
QE-24-SM4-6da (DOI: 10.1002/chem.201803975) |
| Wiley ID |
1901732 |
