CID 135650293
129302-00-7
Structural Information
- Molecular Formula
- C17H14N4O3
- SMILES
- COC1=CC=C(C=C1)/C=N/NC(=O)C2=NC3=CC=CC=C3C(=O)N2
- InChI
- InChI=1S/C17H14N4O3/c1-24-12-8-6-11(7-9-12)10-18-21-17(23)15-19-14-5-3-2-4-13(14)16(22)20-15/h2-10H,1H3,(H,21,23)(H,19,20,22)/b18-10+
- InChIKey
- JZNJGMKPRVVOEA-VCHYOVAHSA-N
- Compound name
- N-[(E)-(4-methoxyphenyl)methylideneamino]-4-oxo-3H-quinazoline-2-carboxamide
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 323.11388 | 172.3 |
[M+Na]+ | 345.09582 | 180.3 |
[M-H]- | 321.09932 | 177.6 |
[M+NH4]+ | 340.14042 | 183.8 |
[M+K]+ | 361.06976 | 175.1 |
[M+H-H2O]+ | 305.10386 | 162.0 |
[M+HCOO]- | 367.10480 | 194.9 |
[M+CH3COO]- | 381.12045 | 211.4 |
[M+Na-2H]- | 343.08127 | 180.0 |
[M]+ | 322.10605 | 173.3 |
[M]- | 322.10715 | 173.3 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.