CID 122240485
1-(but-2-yn-1-yl)-1h-pyrazol-4-ol
Structural Information
- Molecular Formula
- C7H8N2O
- SMILES
- CC#CCN1C=C(C=N1)O
- InChI
- InChI=1S/C7H8N2O/c1-2-3-4-9-6-7(10)5-8-9/h5-6,10H,4H2,1H3
- InChIKey
- UWWAPHQVNKSPAM-UHFFFAOYSA-N
- Compound name
- 1-but-2-ynylpyrazol-4-ol
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 137.07094 | 127.7 |
[M+Na]+ | 159.05288 | 139.0 |
[M+NH4]+ | 154.09748 | 131.7 |
[M+K]+ | 175.02682 | 132.1 |
[M-H]- | 135.05638 | 119.5 |
[M+Na-2H]- | 157.03833 | 130.1 |
[M]+ | 136.06311 | 126.0 |
[M]- | 136.06421 | 126.0 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.