CID 121207582

1,1-difluorospiro[2.3]hexan-5-amine hydrochloride

Structural Information

Molecular Formula
C6H9F2N
SMILES
C1C(CC12CC2(F)F)N
InChI
InChI=1S/C6H9F2N/c7-6(8)3-5(6)1-4(9)2-5/h4H,1-3,9H2
InChIKey
FZKCFUQYVJGWJZ-UHFFFAOYSA-N
Compound name
2,2-difluorospiro[2.3]hexan-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

20
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 122.5
[M+Na]+ 156.05953 132.1
[M-H]- 132.06303 127.3
[M+NH4]+ 151.10413 137.3
[M+K]+ 172.03347 133.4
[M+H-H2O]+ 116.06757 113.5
[M+HCOO]- 178.06851 142.5
[M+CH3COO]- 192.08416 181.0
[M+Na-2H]- 154.04498 129.9
[M]+ 133.06976 128.5
[M]- 133.07086 128.5
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