| SpectraBase Spectrum ID |
FR5SYLbKkR1 |
| Name |
2-(S,S-Diphenyl)sulfoximidoyl-1-(4-acetoxyphenyl)ethyl 2-iodobenzoate |
| Appearance |
Colorless viscous oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
625.041989046 u |
| Formula |
C29H24INO5S |
| InChI |
InChI=1S/C29H24INO5S/c1-21(32)35-23-18-16-22(17-19-23)28(36-29(33)26-14-8-9-15-27(26)30)20-31-37(34,24-10-4-2-5-11-24)25-12-6-3-7-13-25/h2-19,28H,20H2,1H3 |
| InChIKey |
KRTXPKJGNILOQK-UHFFFAOYSA-N |
| Instrument Name |
Finnigan SSQ 7000 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201803975 |
| Molecular Weight |
625.477 g/mol |
| Quality |
23 |
| Reported Formula |
C29H24INO5S |
| SMILES |
C1=CC(=C(C=C1)I)C(=O)OC(CN=S(C1=CC=CC=C1)(C1=CC=CC=C1)=O)C1=CC=C(C=C1)OC(C)=O |
| SPLASH |
splash10-001i-0910000000-598ffc105d19e5a81f26 |
| Source of Spectrum |
QE-24-SM11-6fg (DOI: 10.1002/chem.201803975) |
| Wiley ID |
1901737 |
