| SpectraBase Spectrum ID |
KD3W467q5Ae |
| Name |
Methyl 4-(4-methoxyphenyl)-4-(S,S-methylphenylsulfoximidoyl)but-2-ynoate |
| Appearance |
Colorless viscous oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
357.103479266 u |
| Formula |
C19H19NO4S |
| InChI |
InChI=1S/C19H19NO4S/c1-23-16-11-9-15(10-12-16)18(13-14-19(21)24-2)20-25(3,22)17-7-5-4-6-8-17/h4-12,18H,1-3H3 |
| InChIKey |
WJCPEEHAKKMEMT-UHFFFAOYSA-N |
| Instrument Name |
Finnigan SSQ 7000 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201801660 |
| Molecular Weight |
357.424 g/mol |
| Quality |
210 |
| Reported Formula |
C19H19NO4S |
| SMILES |
C1(C(C#CC(=O)OC)N=S(C2=CC=CC=C2)(C)=O)=CC=C(OC)C=C1 |
| SPLASH |
splash10-05r3-1940000000-ac992489c8bc7b2ca9ac |
| Sample Comments |
dr = 1:1 |
| Source of Spectrum |
ACI-57-SM13-5c (DOI: 10.1002/anie.201801660) |
| Wiley ID |
1890908 |
