CID 65458361

2-cyclobutyl-1-(pyridin-3-yl)ethan-1-amine

Structural Information

Molecular Formula
C11H16N2
SMILES
C1CC(C1)CC(C2=CN=CC=C2)N
InChI
InChI=1S/C11H16N2/c12-11(7-9-3-1-4-9)10-5-2-6-13-8-10/h2,5-6,8-9,11H,1,3-4,7,12H2
InChIKey
WKVJAISZOWGVHF-UHFFFAOYSA-N
Compound name
2-cyclobutyl-1-pyridin-3-ylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

176.13135 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 177.13863 139.7
[M+Na]+ 199.12057 143.6
[M-H]- 175.12407 143.6
[M+NH4]+ 194.16517 151.1
[M+K]+ 215.09451 144.3
[M+H-H2O]+ 159.12861 126.6
[M+HCOO]- 221.12955 159.9
[M+CH3COO]- 235.14520 186.4
[M+Na-2H]- 197.10602 144.5
[M]+ 176.13080 144.2
[M]- 176.13190 144.2
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.