CID 71320868

88951-18-2

Structural Information

Molecular Formula
C10H12F7NO
SMILES
C1CC(CCC1C(=O)N)C(C(C(F)(F)F)(F)F)(F)F
InChI
InChI=1S/C10H12F7NO/c11-8(12,9(13,14)10(15,16)17)6-3-1-5(2-4-6)7(18)19/h5-6H,1-4H2,(H2,18,19)
InChIKey
BMXVWOGRMNOISH-UHFFFAOYSA-N
Compound name
4-(1,1,2,2,3,3,3-heptafluoropropyl)cyclohexane-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

295.08072 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.08800 158.3
[M+Na]+ 318.06994 164.0
[M-H]- 294.07344 151.6
[M+NH4]+ 313.11454 172.4
[M+K]+ 334.04388 160.9
[M+H-H2O]+ 278.07798 147.6
[M+HCOO]- 340.07892 165.6
[M+CH3COO]- 354.09457 203.3
[M+Na-2H]- 316.05539 158.7
[M]+ 295.08017 142.3
[M]- 295.08127 142.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.