CID 3074668
1h-pyrazole-4-acetic acid, 5-(2-ethyl-4-oxo-3(4h)-quinzolinyl)-1-methyl-, ethyl ester
Structural Information
- Molecular Formula
- C18H20N4O3
- SMILES
- CCC1=NC2=CC=CC=C2C(=O)N1C3=C(C=NN3C)CC(=O)OCC
- InChI
- InChI=1S/C18H20N4O3/c1-4-15-20-14-9-7-6-8-13(14)18(24)22(15)17-12(11-19-21(17)3)10-16(23)25-5-2/h6-9,11H,4-5,10H2,1-3H3
- InChIKey
- NNRPUEWRBMWEBT-UHFFFAOYSA-N
- Compound name
- ethyl 2-[5-(2-ethyl-4-oxoquinazolin-3-yl)-1-methylpyrazol-4-yl]acetate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 341.16081 | 180.9 |
[M+Na]+ | 363.14275 | 196.0 |
[M+NH4]+ | 358.18735 | 186.0 |
[M+K]+ | 379.11669 | 191.2 |
[M-H]- | 339.14625 | 182.1 |
[M+Na-2H]- | 361.12820 | 186.8 |
[M]+ | 340.15298 | 183.3 |
[M]- | 340.15408 | 183.3 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.