CID 14645997

(4-methoxy-3,5-dimethylpyridin-2-yl)methanamine

Structural Information

Molecular Formula
C9H14N2O
SMILES
CC1=CN=C(C(=C1OC)C)CN
InChI
InChI=1S/C9H14N2O/c1-6-5-11-8(4-10)7(2)9(6)12-3/h5H,4,10H2,1-3H3
InChIKey
CNPVFVHYBKQINB-UHFFFAOYSA-N
Compound name
(4-methoxy-3,5-dimethyl-2-pyridinyl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

53
Patents

166.11061 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 167.117886 135.6
[M+Na]+ 189.099828 145.0
[M-H]- 165.103334 138.2
[M+NH4]+ 184.144433 155.2
[M+K]+ 205.073768 143.1
[M+H-H2O]+ 149.107870 129.3
[M+HCOO]- 211.108811 159.5
[M+CH3COO]- 225.124461 183.6
[M+Na-2H]- 187.085276 141.0
[M]+ 166.11006142 136.9
[M]- 166.11115858 136.9
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

patents stripe