| SpectraBase Spectrum ID |
3vZ36uUhHc |
| Name |
3-(4-Isopropylphenyl)-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 |
391.124214711 u |
| Formula |
C23H21NO3S |
| InChI |
InChI=1S/C23H21NO3S/c1-14(2)15-6-8-16(9-7-15)21-22-19(25)4-3-5-20(22)28-23(21)17-10-12-18(13-11-17)24(26)27/h6-14H,3-5H2,1-2H3 |
| InChIKey |
HJYDKMCNJWWGMR-UHFFFAOYSA-N |
| Instrument Name |
Agilent HP 5973 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ejoc.201800361 |
| Molecular Weight |
391.485 g/mol |
| Quality |
305 |
| SMILES |
C1=2SC(=C(C2C(CCC1)=O)C1=CC=C(C=C1)C(C)C)C1=CC=C(C=C1)[N+]([O-])=O |
| SPLASH |
splash10-002f-0019000000-6d889090b85edf8d06f7 |
| Source of Spectrum |
K1-2018-3012-4av (DOI: 10.1002/ejoc.201800361) |
| Wiley ID |
1891761 |
