CID 72218493

6,6-difluorobicyclo[3.1.0]hexan-3-amine hydrochloride

Structural Information

Molecular Formula
C6H9F2N
SMILES
C1C(CC2C1C2(F)F)N
InChI
InChI=1S/C6H9F2N/c7-6(8)4-1-3(9)2-5(4)6/h3-5H,1-2,9H2
InChIKey
SZCZPSZRXWBDBG-UHFFFAOYSA-N
Compound name
6,6-difluorobicyclo[3.1.0]hexan-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

35
Patents

133.07031 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 134.07759 118.6
[M+Na]+ 156.05953 129.9
[M-H]- 132.06303 121.6
[M+NH4]+ 151.10413 140.1
[M+K]+ 172.03347 126.9
[M+H-H2O]+ 116.06757 113.2
[M+HCOO]- 178.06851 139.6
[M+CH3COO]- 192.08416 178.1
[M+Na-2H]- 154.04498 124.5
[M]+ 133.06976 116.4
[M]- 133.07086 116.4
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