| SpectraBase Spectrum ID |
J7ndDHCc62X |
| Name |
3-(2,6-Dichlorophenyl)-6-iodo-2-[(E)-2-phenylethenyl]-4(3H)-quinazolinone |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
517.944963446 u |
| Formula |
C22H13Cl2IN2O |
| InChI |
InChI=1S/C22H13Cl2IN2O/c23-17-7-4-8-18(24)21(17)27-20(12-9-14-5-2-1-3-6-14)26-19-11-10-15(25)13-16(19)22(27)28/h1-13H/b12-9+ |
| InChIKey |
UHDPZGCXYLIKGM-FMIVXFBMSA-N |
| Molecular Weight |
519.169 g/mol |
| SMILES |
C=1C=CC(\C=C\C=2N(C(C=3C=C(I)C=CC3N2)=O)C=2C(Cl)=CC=CC2Cl)=CC1 |