CID 3157461
1-ethyl-3,5-dimethyl-1h-pyrazole-4-carbaldehyde
Structural Information
- Molecular Formula
- C8H12N2O
- SMILES
- CCN1C(=C(C(=N1)C)C=O)C
- InChI
- InChI=1S/C8H12N2O/c1-4-10-7(3)8(5-11)6(2)9-10/h5H,4H2,1-3H3
- InChIKey
- NDKOKWXOWTVYJR-UHFFFAOYSA-N
- Compound name
- 1-ethyl-3,5-dimethylpyrazole-4-carbaldehyde
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 153.10224 | 132.6 |
[M+Na]+ | 175.08418 | 145.0 |
[M+NH4]+ | 170.12878 | 140.1 |
[M+K]+ | 191.05812 | 140.9 |
[M-H]- | 151.08768 | 132.8 |
[M+Na-2H]- | 173.06963 | 137.5 |
[M]+ | 152.09441 | 134.2 |
[M]- | 152.09551 | 134.2 |