CID 154577446

8,8-difluorobicyclo[3.2.1]octan-3-amine hydrochloride

Structural Information

Molecular Formula
C8H13F2N
SMILES
C1CC2CC(CC1C2(F)F)N
InChI
InChI=1S/C8H13F2N/c9-8(10)5-1-2-6(8)4-7(11)3-5/h5-7H,1-4,11H2
InChIKey
HJCQFYZUIJQQKW-UHFFFAOYSA-N
Compound name
8,8-difluorobicyclo[3.2.1]octan-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

161.10161 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 162.10889 131.6
[M+Na]+ 184.09083 139.2
[M-H]- 160.09433 131.3
[M+NH4]+ 179.13543 157.5
[M+K]+ 200.06477 136.2
[M+H-H2O]+ 144.09887 125.9
[M+HCOO]- 206.09981 149.3
[M+CH3COO]- 220.11546 179.8
[M+Na-2H]- 182.07628 135.8
[M]+ 161.10106 123.8
[M]- 161.10216 123.8
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.