CID 83854447

(3-fluorocyclohexyl)methanamine hydrochloride

Structural Information

Molecular Formula

SMILES

C1CC(CC(C1)F)CN

InChI

InChI=1S/C7H14FN/c8-7-3-1-2-6(4-7)5-9/h6-7H,1-5,9H2

InChIKey

WUFAQPHIHBJLDD-UHFFFAOYSA-N

Compound name

(3-fluorocyclohexyl)methanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 131.11102 Da
Monoisotopic Mass: 1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	132.118296	127.3
[M+Na]+	154.100238	132.5
[M-H]-	130.103744	128.5
[M+NH4]+	149.144843	148.7
[M+K]+	170.074178	131.1
[M+H-H2O]+	114.108280	121.1
[M+HCOO]-	176.109221	147.5
[M+CH3COO]-	190.124871	174.3
[M+Na-2H]-	152.085686	131.5
[M]+	131.11047142	119.6
[M]-	131.11156858	119.6

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.