CID 55282136
3,3,3-trifluoropropane-1,2-diamine dihydrochloride
Structural Information
- Molecular Formula
- C3H7F3N2
- SMILES
- C(C(C(F)(F)F)N)N
- InChI
- InChI=1S/C3H7F3N2/c4-3(5,6)2(8)1-7/h2H,1,7-8H2
- InChIKey
- QXIHYHUYKPDZLT-UHFFFAOYSA-N
- Compound name
- 3,3,3-trifluoropropane-1,2-diamine
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 129.06342 | 121.1 |
[M+Na]+ | 151.04536 | 128.1 |
[M-H]- | 127.04886 | 116.8 |
[M+NH4]+ | 146.08996 | 142.0 |
[M+K]+ | 167.01930 | 127.5 |
[M+H-H2O]+ | 111.05340 | 114.1 |
[M+HCOO]- | 173.05434 | 140.8 |
[M+CH3COO]- | 187.06999 | 175.2 |
[M+Na-2H]- | 149.03081 | 125.5 |
[M]+ | 128.05559 | 112.4 |
[M]- | 128.05669 | 112.4 |