| SpectraBase Spectrum ID |
BMFfyCdsIhg |
| Name |
Ethyl 2-(4-methoxyphenyl)-2-(S,S-methylphenylsulfoximidoyl)acetate |
| Appearance |
Yellow viscous oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
347.119129330 u |
| Formula |
C18H21NO4S |
| InChI |
InChI=1S/C18H21NO4S/c1-4-23-18(20)17(14-10-12-15(22-2)13-11-14)19-24(3,21)16-8-6-5-7-9-16/h5-13,17H,4H2,1-3H3 |
| InChIKey |
VTCFXBHZHGNAMO-UHFFFAOYSA-N |
| Instrument Name |
Finnigan SSQ 7000 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201801660 |
| Molecular Weight |
347.429 g/mol |
| Quality |
170 |
| Reported Formula |
C18H21NO4S |
| SMILES |
C=1(C(C(=O)OCC)N=S(C2=CC=CC=C2)(C)=O)C=CC(=CC1)OC |
| SPLASH |
splash10-00bc-4920000000-6e45c3d0846d10ab87ab |
| Sample Comments |
dr = 1:1 |
| Source of Spectrum |
ACI-57-SM11-4d (DOI: 10.1002/anie.201801660) |
| Wiley ID |
1890901 |
