CID 142576662

6,6-difluoro-4-azaspiro[2.4]heptane hydrochloride

Structural Information

Molecular Formula
C6H9F2N
SMILES
C1CC12CC(CN2)(F)F
InChI
InChI=1S/C6H9F2N/c7-6(8)3-5(1-2-5)9-4-6/h9H,1-4H2
InChIKey
TTXNELNYWXNSLM-UHFFFAOYSA-N
Compound name
6,6-difluoro-4-azaspiro[2.4]heptane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

56
Patents

133.07031 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 134.07759 124.2
[M+Na]+ 156.05953 134.4
[M-H]- 132.06303 125.9
[M+NH4]+ 151.10413 144.8
[M+K]+ 172.03347 132.3
[M+H-H2O]+ 116.06757 118.1
[M+HCOO]- 178.06851 142.2
[M+CH3COO]- 192.08416 137.3
[M+Na-2H]- 154.04498 130.9
[M]+ 133.06976 120.0
[M]- 133.07086 120.0
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