CID 54594222

N-(2,2-dimethylpropyl)pyridin-3-amine

Structural Information

Molecular Formula
C10H16N2
SMILES
CC(C)(C)CNC1=CN=CC=C1
InChI
InChI=1S/C10H16N2/c1-10(2,3)8-12-9-5-4-6-11-7-9/h4-7,12H,8H2,1-3H3
InChIKey
GNYFTORFAKIQDR-UHFFFAOYSA-N
Compound name
N-(2,2-dimethylpropyl)pyridin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

8
Patents

164.13135 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 165.13863 137.6
[M+Na]+ 187.12057 144.4
[M-H]- 163.12407 139.8
[M+NH4]+ 182.16517 157.0
[M+K]+ 203.09451 142.5
[M+H-H2O]+ 147.12861 131.3
[M+HCOO]- 209.12955 160.1
[M+CH3COO]- 223.14520 181.5
[M+Na-2H]- 185.10602 146.4
[M]+ 164.13080 137.2
[M]- 164.13190 137.2
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