SpectraBase Spectrum ID |
E4znoOMCasT |
Name |
(Z)-N-{2-Bromo-2-{[(2-ethoxycarbonyl)phenoxy]carbonyl]}}vinyl-S-phenyl-S-methyl sulfoximine |
Appearance |
Colorless oil |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
451.008906853 u |
Formula |
C19H18BrNO5S |
InChI |
InChI=1S/C19H18BrNO5S/c1-3-25-18(22)15-11-7-8-12-17(15)26-19(23)16(20)13-21-27(2,24)14-9-5-4-6-10-14/h4-13H,3H2,1-2H3/b16-13- |
InChIKey |
OICSBVNTVFPOCW-SSZFMOIBSA-N |
Instrument Name |
Finnigan SSQ 7000 |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/chem.201501629 |
Molecular Weight |
452.319 g/mol |
Quality |
213 |
Reported Formula |
C19H18O5NBrS |
SMILES |
C1(OC(=O)\C(=C\N=S(=O)(C2=CC=CC=C2)C)Br)=CC=CC=C1C(OCC)=O |
SPLASH |
splash10-00bi-4920000000-cf976b1993528c494a74 |
Source of Spectrum |
QE-21-SM6-3i (DOI: 10.1002/chem.201501629) |
Wiley ID |
1906781 |