CID 22767593

1-(pyridin-2-yl)butan-1-amine

Structural Information

Molecular Formula
C9H14N2
SMILES
CCCC(C1=CC=CC=N1)N
InChI
InChI=1S/C9H14N2/c1-2-5-8(10)9-6-3-4-7-11-9/h3-4,6-8H,2,5,10H2,1H3
InChIKey
BFKHSLAQEYFTPC-UHFFFAOYSA-N
Compound name
1-pyridin-2-ylbutan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

101
Patents

150.11569 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 151.122966 133.3
[M+Na]+ 173.104908 139.7
[M-H]- 149.108414 134.9
[M+NH4]+ 168.149513 152.7
[M+K]+ 189.078848 137.7
[M+H-H2O]+ 133.112950 126.6
[M+HCOO]- 195.113891 156.1
[M+CH3COO]- 209.129541 178.9
[M+Na-2H]- 171.090356 139.7
[M]+ 150.11514142 131.4
[M]- 150.11623858 131.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe