CID 60143882
Me1111
Structural Information
- Molecular Formula
- C12H14N2O
- SMILES
- CC1=CC(=C(C=C1)N2C(=CC(=N2)C)C)O
- InChI
- InChI=1S/C12H14N2O/c1-8-4-5-11(12(15)6-8)14-10(3)7-9(2)13-14/h4-7,15H,1-3H3
- InChIKey
- VQXHPRBERPTLQW-UHFFFAOYSA-N
- Compound name
- 2-(3,5-dimethylpyrazol-1-yl)-5-methylphenol
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 203.11789 | 145.4 |
[M+Na]+ | 225.09983 | 159.8 |
[M+NH4]+ | 220.14443 | 153.5 |
[M+K]+ | 241.07377 | 154.9 |
[M-H]- | 201.10333 | 148.1 |
[M+Na-2H]- | 223.08528 | 152.8 |
[M]+ | 202.11006 | 148.2 |
[M]- | 202.11116 | 148.2 |