| SpectraBase Spectrum ID |
Az2yheKNn4s |
| Name |
3-(4-Methoxyphenyl)-6,6-dimethyl-2-(4-nitrophenyl)-6,7-dihydro-1-benzothiophen-4(5H)-one |
| Appearance |
Pale-yellow solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
407.119129330 u |
| Formula |
C23H21NO4S |
| InChI |
InChI=1S/C23H21NO4S/c1-23(2)12-18(25)21-19(13-23)29-22(15-4-8-16(9-5-15)24(26)27)20(21)14-6-10-17(28-3)11-7-14/h4-11H,12-13H2,1-3H3 |
| InChIKey |
VAZIWPKRIFWOBV-UHFFFAOYSA-N |
| Instrument Name |
Agilent HP 5973 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ejoc.201800361 |
| Molecular Weight |
407.484 g/mol |
| Quality |
362 |
| SMILES |
C1=2SC(=C(C2C(CC(C1)(C)C)=O)C1=CC=C(C=C1)OC)C1=CC=C(C=C1)[N+]([O-])=O |
| SPLASH |
splash10-0a4i-7673900000-b4f18e262ce1a0f34c97 |
| Source of Spectrum |
K1-2018-3012-4ba (DOI: 10.1002/ejoc.201800361) |
| Wiley ID |
1891767 |
