| SpectraBase Spectrum ID |
CMF9dEP8wSd |
| Name |
6,6-Dimethyl-2-(4-nitrophenyl)-3-phenyl-6,7-dihydro-1-benzothiophen-4(5H)-one |
| Appearance |
Pale-yellow crystals |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
377.108564647 u |
| Formula |
C22H19NO3S |
| InChI |
InChI=1S/C22H19NO3S/c1-22(2)12-17(24)20-18(13-22)27-21(19(20)14-6-4-3-5-7-14)15-8-10-16(11-9-15)23(25)26/h3-11H,12-13H2,1-2H3 |
| InChIKey |
PNIYPEYUZZIYGV-UHFFFAOYSA-N |
| Instrument Name |
Agilent HP 5973 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ejoc.201800361 |
| Molecular Weight |
377.458 g/mol |
| Quality |
257 |
| SMILES |
C1=2SC(=C(C2C(CC(C1)(C)C)=O)C1=CC=CC=C1)C1=CC=C(C=C1)[N+]([O-])=O |
| SPLASH |
splash10-00b9-0059000000-e44f7b7621622a13660e |
| Source of Spectrum |
K1-2018-3012-4aw (DOI: 10.1002/ejoc.201800361) |
| Wiley ID |
1891762 |
