| SpectraBase Spectrum ID |
Gh1EpJwKe9F |
| Name |
6,6-Dimethyl-3-(3-methylphenyl)-2-(4-nitrophenyl)-6,7-dihydro-1-benzohiophen-4(5H)-one |
| Appearance |
Yellow solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
391.124214711 u |
| Formula |
C23H21NO3S |
| InChI |
InChI=1S/C23H21NO3S/c1-14-5-4-6-16(11-14)20-21-18(25)12-23(2,3)13-19(21)28-22(20)15-7-9-17(10-8-15)24(26)27/h4-11H,12-13H2,1-3H3 |
| InChIKey |
CXGGPLGJOGHETM-UHFFFAOYSA-N |
| Instrument Name |
Agilent HP 5973 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ejoc.201800361 |
| Molecular Weight |
391.485 g/mol |
| Quality |
261 |
| SMILES |
C1=2SC(=C(C2C(CC(C1)(C)C)=O)C1=CC(=CC=C1)C)C1=CC=C(C=C1)[N+]([O-])=O |
| SPLASH |
splash10-000f-0049000000-2bd84d112269e8aa2340 |
| Source of Spectrum |
K1-2018-3012-4ax (DOI: 10.1002/ejoc.201800361) |
| Wiley ID |
1891763 |
