CID 61520340

1-(5-fluoropyridin-3-yl)-3-methylbutan-1-amine

Structural Information

Molecular Formula
C10H15FN2
SMILES
CC(C)CC(C1=CC(=CN=C1)F)N
InChI
InChI=1S/C10H15FN2/c1-7(2)3-10(12)8-4-9(11)6-13-5-8/h4-7,10H,3,12H2,1-2H3
InChIKey
UQLHFIJNGMDKDS-UHFFFAOYSA-N
Compound name
1-(5-fluoropyridin-3-yl)-3-methylbutan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

182.12193 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.12921 140.7
[M+Na]+ 205.11115 147.4
[M-H]- 181.11465 141.2
[M+NH4]+ 200.15575 158.9
[M+K]+ 221.08509 145.2
[M+H-H2O]+ 165.11919 133.1
[M+HCOO]- 227.12013 161.0
[M+CH3COO]- 241.13578 186.7
[M+Na-2H]- 203.09660 144.0
[M]+ 182.12138 137.8
[M]- 182.12248 137.8
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.