| SpectraBase Spectrum ID |
DgzNhfnpEV4 |
| Name |
2-(4-Nitrophenyl)-3-phenyl-6,7-dihydro-1-benzothiophen-4(5H)-one |
| Appearance |
Pale-brown solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H15NO3S |
| InChI |
InChI=1S/C20H15NO3S/c22-16-7-4-8-17-19(16)18(13-5-2-1-3-6-13)20(25-17)14-9-11-15(12-10-14)21(23)24/h1-3,5-6,9-12H,4,7-8H2 |
| InChIKey |
PKAJDEDMIPHSGE-UHFFFAOYSA-N |
| Instrument Name |
Agilent HP 5973 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ejoc.201800361 |
| Molecular Weight |
349.404 g/mol |
| Quality |
393 |
| SMILES |
C1=2SC(=C(C2C(CCC1)=O)C1=CC=CC=C1)C1=CC=C(C=C1)[N+]([O-])=O |
| SPLASH |
splash10-0002-2149000000-a8c900d6494f2a51072e |
| Source of Spectrum |
K1-2018-3011-4as (DOI: 10.1002/ejoc.201800361) |
| Wiley ID |
1891757 |
