CID 21027526

Cis-4-fluorocyclohexanamine hydrochloride

Structural Information

Molecular Formula
C6H12FN
SMILES
C1CC(CCC1N)F
InChI
InChI=1S/C6H12FN/c7-5-1-3-6(8)4-2-5/h5-6H,1-4,8H2
InChIKey
VHTWEUCMRHPAAN-UHFFFAOYSA-N
Compound name
4-fluorocyclohexan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

123
Patents

117.095375 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 118.10265 123.3
[M+Na]+ 140.08459 133.0
[M+NH4]+ 135.12920 132.4
[M+K]+ 156.05853 127.0
[M-H]- 116.08810 124.9
[M+Na-2H]- 138.07004 128.4
[M]+ 117.09483 124.8
[M]- 117.09592 124.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe