SpectraBase Spectrum ID |
GRbY2m2fWsp |
Name |
Ethyl 2-(benzo[b]thiophen-3-yl)-2-(S,S-methylphenylsulfoximidoyl)acetate |
Appearance |
Yellow viscous oil |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
373.080635821 u |
Formula |
C19H19NO3S2 |
InChI |
InChI=1S/C19H19NO3S2/c1-3-23-19(21)18(16-13-24-17-12-8-7-11-15(16)17)20-25(2,22)14-9-5-4-6-10-14/h4-13,18H,3H2,1-2H3 |
InChIKey |
NKHQQVHVQCOTDK-UHFFFAOYSA-N |
Instrument Name |
Finnigan SSQ 7000 |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/anie.201801660 |
Molecular Weight |
373.485 g/mol |
Quality |
148 |
Reported Formula |
C19H19NO3S2 |
SMILES |
C1(C(C(=O)OCC)N=S(C2=CC=CC=C2)(C)=O)=CSC2=C1C=CC=C2 |
SPLASH |
splash10-0ufu-2904000000-59d2248095705a17b6ea |
Sample Comments |
dr = 1:1 |
Source of Spectrum |
ACI-57-SM12-4h (DOI: 10.1002/anie.201801660) |
Wiley ID |
1890905 |