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]+ 120.118306 125.7
[M+Na]+ 142.100248 132.5
[M-H]- 118.103754 124.3
[M+NH4]+ 137.144853 147.9
[M+K]+ 158.074188 131.9
[M+H-H2O]+ 102.108290 120.7
[M+HCOO]- 164.109231 147.3
[M+CH3COO]- 178.124881 174.3
[M+Na-2H]- 140.085696 131.9
[M]+ 119.11048142 123.4
[M]- 119.11157858 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