| SpectraBase Spectrum ID |
JhniCfVG0U5 |
| Name |
(E)-2-((4-Chlorobenzyl) thio)-8-(4-Chlorobenzylidene)-4-(4-Chlorophenyl)-5,6,7,8-tetr hydroquinoline-3-Carbonitrile |
| Appearance |
Yellow crystals |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
546.049102958 u |
| Formula |
C30H21Cl3N2S |
| InChI |
InChI=1S/C30H21Cl3N2S/c31-23-10-4-19(5-11-23)16-22-2-1-3-26-28(21-8-14-25(33)15-9-21)27(17-34)30(35-29(22)26)36-18-20-6-12-24(32)13-7-20/h4-16H,1-3,18H2/b22-16+ |
| InChIKey |
CVGBBGWPMJAICM-CJLVFECKSA-N |
| Instrument Name |
Hewlett Packard MS-5988-USA or Joel-JMS 600 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1016/j.arabjc.2023.104543 |
| Molecular Weight |
547.931 g/mol |
| Quality |
797 |
| SMILES |
C(SC1=NC=2\C(CCCC2C(=C1C#N)C1=CC=C(C=C1)Cl)=C\C1=CC=C(C=C1)Cl)C1=CC=C(C=C1)Cl |
| SPLASH |
splash10-002b-0525590000-d63a19f9588f03b70bfa |
| Source of Spectrum |
AJC-16-SM6-7d (DOI: 10.1016/j.arabjc.2023.104543) |
| Wiley ID |
1911057 |
