CID 112562670

3-ethyl-2-fluoropentan-1-amine hydrochloride

Structural Information

Molecular Formula
C7H16FN
SMILES
CCC(CC)C(CN)F
InChI
InChI=1S/C7H16FN/c1-3-6(4-2)7(8)5-9/h6-7H,3-5,9H2,1-2H3
InChIKey
VWSHGRNITPUOLZ-UHFFFAOYSA-N
Compound name
3-ethyl-2-fluoropentan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

133.12668 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 134.133956 131.7
[M+Na]+ 156.115898 137.2
[M-H]- 132.119404 129.9
[M+NH4]+ 151.160503 153.1
[M+K]+ 172.089838 136.8
[M+H-H2O]+ 116.123940 125.9
[M+HCOO]- 178.124881 152.4
[M+CH3COO]- 192.140531 178.8
[M+Na-2H]- 154.101346 134.2
[M]+ 133.12613142 128.9
[M]- 133.12722858 128.9
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.