CID 83814983

4-fluoro-4-methylpentan-1-amine hydrochloride

Structural Information

Molecular Formula
C6H14FN
SMILES
CC(C)(CCCN)F
InChI
InChI=1S/C6H14FN/c1-6(2,7)4-3-5-8/h3-5,8H2,1-2H3
InChIKey
ZORDECCTTMQXDR-UHFFFAOYSA-N
Compound name
4-fluoro-4-methylpentan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

119.11103 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 120.11831 125.7
[M+Na]+ 142.10025 132.5
[M-H]- 118.10375 124.3
[M+NH4]+ 137.14485 147.9
[M+K]+ 158.07419 131.9
[M+H-H2O]+ 102.10829 120.7
[M+HCOO]- 164.10923 147.3
[M+CH3COO]- 178.12488 174.3
[M+Na-2H]- 140.08570 131.9
[M]+ 119.11048 123.4
[M]- 119.11158 123.4
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

patents stripe