| SpectraBase Spectrum ID |
9cNObHs2bIq |
| Name |
3-(3-(4-Chlorophenyl)-1-phenylprop-2-yn-1-ylidene)-1-tosylindolin-2-one |
| Appearance |
Yellow solid |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
509.085242379 u |
| Formula |
C30H20ClNO3S |
| InChI |
InChI=1S/C30H20ClNO3S/c1-21-11-18-25(19-12-21)36(34,35)32-28-10-6-5-9-27(28)29(30(32)33)26(23-7-3-2-4-8-23)20-15-22-13-16-24(31)17-14-22/h2-14,16-19H,1H3 |
| InChIKey |
YMVBGQYZJNFFPM-UHFFFAOYSA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201802237 |
| Molecular Weight |
510.007 g/mol |
| Reported Formula |
C30H20(35)ClNO3S |
| SMILES |
C1(Cl)=CC=C(C=C1)C#CC(C1=CC=CC=C1)=C1C(N(C2=C1C=CC=C2)S(C1=CC=C(C=C1)C)(=O)=O)=O |
| SPLASH |
splash10-0zfr-0009060000-2c9bc7c70d1a64bf4c02 |
| Sample Comments |
E/Z = 33:67 |
| Source of Spectrum |
QE-24-SM8-5e (DOI: 10.1002/chem.201802237) |
| Wiley ID |
1901708 |
