CID 4307928
4-[(3,5-dimethyl-1h-pyrazol-1-yl)methyl]aniline
Structural Information
- Molecular Formula
- C12H15N3
- SMILES
- CC1=CC(=NN1CC2=CC=C(C=C2)N)C
- InChI
- InChI=1S/C12H15N3/c1-9-7-10(2)15(14-9)8-11-3-5-12(13)6-4-11/h3-7H,8,13H2,1-2H3
- InChIKey
- CHUSCRKGELSGLN-UHFFFAOYSA-N
- Compound name
- 4-[(3,5-dimethylpyrazol-1-yl)methyl]aniline
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 202.13388 | 145.6 |
[M+Na]+ | 224.11582 | 159.1 |
[M+NH4]+ | 219.16042 | 154.0 |
[M+K]+ | 240.08976 | 153.9 |
[M-H]- | 200.11932 | 149.4 |
[M+Na-2H]- | 222.10127 | 153.6 |
[M]+ | 201.12605 | 148.6 |
[M]- | 201.12715 | 148.6 |
Literature stripe
No literature data available for this compound.