CID 23337901
5-methoxy-1-methyl-3-(propan-2-yl)-1h-pyrazole-4-carbaldehyde
Structural Information
- Molecular Formula
- C9H14N2O2
- SMILES
- CC(C)C1=NN(C(=C1C=O)OC)C
- InChI
- InChI=1S/C9H14N2O2/c1-6(2)8-7(5-12)9(13-4)11(3)10-8/h5-6H,1-4H3
- InChIKey
- HYDMAORXQDQKDE-UHFFFAOYSA-N
- Compound name
- 5-methoxy-1-methyl-3-propan-2-ylpyrazole-4-carbaldehyde
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 183.11281 | 138.2 |
[M+Na]+ | 205.09475 | 148.3 |
[M-H]- | 181.09825 | 140.0 |
[M+NH4]+ | 200.13935 | 158.1 |
[M+K]+ | 221.06869 | 147.4 |
[M+H-H2O]+ | 165.10279 | 131.8 |
[M+HCOO]- | 227.10373 | 160.6 |
[M+CH3COO]- | 241.11938 | 184.3 |
[M+Na-2H]- | 203.08020 | 140.8 |
[M]+ | 182.10498 | 142.6 |
[M]- | 182.10608 | 142.6 |
Literature stripe
No literature data available for this compound.