CID 6435586
100243-28-5
Structural Information
- Molecular Formula
- C19H13N3O
- SMILES
- C1=CC=C(C=C1)C(=O)NC2=CC=CC=C2/C=C\C=C(C#N)C#N
- InChI
- InChI=1S/C19H13N3O/c20-13-15(14-21)7-6-11-16-8-4-5-12-18(16)22-19(23)17-9-2-1-3-10-17/h1-12H,(H,22,23)/b11-6-
- InChIKey
- QYHPLTCUEZGMQG-WDZFZDKYSA-N
- Compound name
- N-[2-[(1Z)-4,4-dicyanobuta-1,3-dienyl]phenyl]benzamide
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 300.11315 | 188.7 |
[M+Na]+ | 322.09509 | 197.1 |
[M-H]- | 298.09859 | 192.2 |
[M+NH4]+ | 317.13969 | 197.6 |
[M+K]+ | 338.06903 | 189.5 |
[M+H-H2O]+ | 282.10313 | 171.6 |
[M+HCOO]- | 344.10407 | 199.9 |
[M+CH3COO]- | 358.11972 | 229.2 |
[M+Na-2H]- | 320.08054 | 187.4 |
[M]+ | 299.10532 | 178.6 |
[M]- | 299.10642 | 178.6 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.