CID 9589325
Brn 3639019
Structural Information
- Molecular Formula
- C30H23N7O2
- SMILES
- CC1=NC2=CC=CC=C2C(=O)N1/N=C(/C3=CC=CC=C3)\N=NC4=CC=C(C=C4)C(=O)N/N=C/C5=CC=CC=C5
- InChI
- InChI=1S/C30H23N7O2/c1-21-32-27-15-9-8-14-26(27)30(39)37(21)36-28(23-12-6-3-7-13-23)34-33-25-18-16-24(17-19-25)29(38)35-31-20-22-10-4-2-5-11-22/h2-20H,1H3,(H,35,38)/b31-20+,34-33?,36-28-
- InChIKey
- CWBNJGHAPCGVOK-XNLVTFMISA-N
- Compound name
- N-[(E)-benzylideneamino]-4-[[(Z)-N-(2-methyl-4-oxoquinazolin-3-yl)-C-phenylcarbonimidoyl]diazenyl]benzamide
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 514.19863 | 223.3 |
[M+Na]+ | 536.18057 | 227.7 |
[M-H]- | 512.18407 | 238.0 |
[M+NH4]+ | 531.22517 | 227.0 |
[M+K]+ | 552.15451 | 221.6 |
[M+H-H2O]+ | 496.18861 | 207.2 |
[M+HCOO]- | 558.18955 | 250.7 |
[M+CH3COO]- | 572.20520 | 230.6 |
[M+Na-2H]- | 534.16602 | 231.2 |
[M]+ | 513.19080 | 224.6 |
[M]- | 513.19190 | 224.6 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.