CID 46942231
4,4-difluorocyclohexanecarboxamide
Structural Information
- Molecular Formula
- C7H11F2NO
- SMILES
- C1CC(CCC1C(=O)N)(F)F
- InChI
- InChI=1S/C7H11F2NO/c8-7(9)3-1-5(2-4-7)6(10)11/h5H,1-4H2,(H2,10,11)
- InChIKey
- JKPXYSGFTYLPTJ-UHFFFAOYSA-N
- Compound name
- 4,4-difluorocyclohexane-1-carboxamide
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 164.08815 | 131.8 |
[M+Na]+ | 186.07009 | 138.0 |
[M-H]- | 162.07359 | 132.0 |
[M+NH4]+ | 181.11469 | 153.6 |
[M+K]+ | 202.04403 | 136.7 |
[M+H-H2O]+ | 146.07813 | 125.5 |
[M+HCOO]- | 208.07907 | 150.3 |
[M+CH3COO]- | 222.09472 | 178.6 |
[M+Na-2H]- | 184.05554 | 135.2 |
[M]+ | 163.08032 | 123.2 |
[M]- | 163.08142 | 123.2 |