CID 84716014

2824986-64-1

Structural Information

Molecular Formula
C6H12FN
SMILES
C1C(CC1CF)CN
InChI
InChI=1S/C6H12FN/c7-3-5-1-6(2-5)4-8/h5-6H,1-4,8H2
InChIKey
XJUXHVPGYRNYFP-UHFFFAOYSA-N
Compound name
[3-(fluoromethyl)cyclobutyl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

117.095375 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 118.10265 123.0
[M+Na]+ 140.08459 128.6
[M-H]- 116.08810 124.8
[M+NH4]+ 135.12920 138.7
[M+K]+ 156.05853 130.6
[M+H-H2O]+ 100.09264 112.1
[M+HCOO]- 162.09358 144.4
[M+CH3COO]- 176.10923 176.6
[M+Na-2H]- 138.07004 127.7
[M]+ 117.09483 127.4
[M]- 117.09592 127.4
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.