CID 122164507
Rac-(1r,2r,3s)-3-amino-2-(4-methyl-1h-pyrazol-1-yl)cyclobutan-1-ol dihydrochloride
Structural Information
- Molecular Formula
- C8H13N3O
- SMILES
- CC1=CN(N=C1)[C@@H]2[C@H](C[C@H]2O)N
- InChI
- InChI=1S/C8H13N3O/c1-5-3-10-11(4-5)8-6(9)2-7(8)12/h3-4,6-8,12H,2,9H2,1H3/t6-,7+,8+/m0/s1
- InChIKey
- KDYGKJXNUZDJJP-XLPZGREQSA-N
- Compound name
- (1R,2R,3S)-3-amino-2-(4-methylpyrazol-1-yl)cyclobutan-1-ol
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 168.11315 | 135.6 |
[M+Na]+ | 190.09509 | 142.6 |
[M-H]- | 166.09859 | 138.4 |
[M+NH4]+ | 185.13969 | 148.0 |
[M+K]+ | 206.06903 | 143.2 |
[M+H-H2O]+ | 150.10313 | 123.4 |
[M+HCOO]- | 212.10407 | 155.7 |
[M+CH3COO]- | 226.11972 | 182.4 |
[M+Na-2H]- | 188.08054 | 138.0 |
[M]+ | 167.10532 | 141.5 |
[M]- | 167.10642 | 141.5 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.