CID 817736

N,3-dimethylpyridin-4-amine

Structural Information

Molecular Formula
C7H10N2
SMILES
CC1=C(C=CN=C1)NC
InChI
InChI=1S/C7H10N2/c1-6-5-9-4-3-7(6)8-2/h3-5H,1-2H3,(H,8,9)
InChIKey
HSOBREMHIAAEND-UHFFFAOYSA-N
Compound name
N,3-dimethylpyridin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

95
Patents

122.0844 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 123.09168 122.8
[M+Na]+ 145.07362 131.3
[M-H]- 121.07712 125.6
[M+NH4]+ 140.11822 144.0
[M+K]+ 161.04756 129.8
[M+H-H2O]+ 105.08166 116.7
[M+HCOO]- 167.08260 147.9
[M+CH3COO]- 181.09825 173.8
[M+Na-2H]- 143.05907 131.9
[M]+ 122.08385 122.2
[M]- 122.08495 122.2
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