CID 165587924

2731014-27-8

Structural Information

Molecular Formula
C6H10F3N
SMILES
C1C(CC1(F)F)(CN)CF
InChI
InChI=1S/C6H10F3N/c7-3-5(4-10)1-6(8,9)2-5/h1-4,10H2
InChIKey
MMGSWWODWGPDAQ-UHFFFAOYSA-N
Compound name
[3,3-difluoro-1-(fluoromethyl)cyclobutyl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

153.07654 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.083816 130.6
[M+Na]+ 176.065758 138.1
[M-H]- 152.069264 130.6
[M+NH4]+ 171.110363 148.7
[M+K]+ 192.039698 139.2
[M+H-H2O]+ 136.073800 120.6
[M+HCOO]- 198.074741 149.8
[M+CH3COO]- 212.090391 181.4
[M+Na-2H]- 174.051206 136.0
[M]+ 153.07599142 133.3
[M]- 153.07708858 133.3
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.