CID 60922535

(cyclobutylmethyl)(2,2-difluoroethyl)amine hydrochloride

Structural Information

Molecular Formula
C7H13F2N
SMILES
C1CC(C1)CNCC(F)F
InChI
InChI=1S/C7H13F2N/c8-7(9)5-10-4-6-2-1-3-6/h6-7,10H,1-5H2
InChIKey
KPYZWBAPTXFEPM-UHFFFAOYSA-N
Compound name
N-(cyclobutylmethyl)-2,2-difluoroethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

149.10161 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 150.108886 131.7
[M+Na]+ 172.090828 135.7
[M-H]- 148.094334 132.1
[M+NH4]+ 167.135433 145.9
[M+K]+ 188.064768 137.8
[M+H-H2O]+ 132.098870 119.3
[M+HCOO]- 194.099811 151.3
[M+CH3COO]- 208.115461 182.7
[M+Na-2H]- 170.076276 135.5
[M]+ 149.10106142 135.3
[M]- 149.10215858 135.3
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.