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]+ 154.08382 130.6
[M+Na]+ 176.06576 138.1
[M-H]- 152.06926 130.6
[M+NH4]+ 171.11036 148.7
[M+K]+ 192.03970 139.2
[M+H-H2O]+ 136.07380 120.6
[M+HCOO]- 198.07474 149.8
[M+CH3COO]- 212.09039 181.4
[M+Na-2H]- 174.05121 136.0
[M]+ 153.07599 133.3
[M]- 153.07709 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.