CID 105431590

4,4-difluoro-2-azaspiro[4.4]nonane hydrochloride

Structural Information

Molecular Formula
C8H13F2N
SMILES
C1CCC2(C1)CNCC2(F)F
InChI
InChI=1S/C8H13F2N/c9-8(10)6-11-5-7(8)3-1-2-4-7/h11H,1-6H2
InChIKey
FOQZKZYPJNOEJM-UHFFFAOYSA-N
Compound name
4,4-difluoro-2-azaspiro[4.4]nonane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

161.10161 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 162.10889 133.6
[M+Na]+ 184.09083 140.8
[M-H]- 160.09433 133.8
[M+NH4]+ 179.13543 159.6
[M+K]+ 200.06477 137.9
[M+H-H2O]+ 144.09887 126.9
[M+HCOO]- 206.09981 150.8
[M+CH3COO]- 220.11546 145.9
[M+Na-2H]- 182.07628 136.7
[M]+ 161.10106 124.1
[M]- 161.10216 124.1
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

No patent data available for this compound.