CID 53429221

4-(difluoromethyl)bicyclo[2.2.1]heptan-1-amine hydrochloride

Structural Information

Molecular Formula
C8H13F2N
SMILES
C1CC2(CCC1(C2)C(F)F)N
InChI
InChI=1S/C8H13F2N/c9-6(10)7-1-3-8(11,5-7)4-2-7/h6H,1-5,11H2
InChIKey
IDBCDMVFDINIGC-UHFFFAOYSA-N
Compound name
4-(difluoromethyl)bicyclo[2.2.1]heptan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

161.10161 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 162.108886 133.8
[M+Na]+ 184.090828 141.1
[M-H]- 160.094334 133.6
[M+NH4]+ 179.135433 162.6
[M+K]+ 200.064768 138.6
[M+H-H2O]+ 144.098870 128.6
[M+HCOO]- 206.099811 152.6
[M+CH3COO]- 220.115461 178.3
[M+Na-2H]- 182.076276 137.8
[M]+ 161.10106142 127.1
[M]- 161.10215858 127.1
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

patents stripe