CID 11644036

4-methyl-2-(p-tolyl)pyridine

Structural Information

Molecular Formula
C13H13N
SMILES
CC1=CC=C(C=C1)C2=NC=CC(=C2)C
InChI
InChI=1S/C13H13N/c1-10-3-5-12(6-4-10)13-9-11(2)7-8-14-13/h3-9H,1-2H3
InChIKey
ZOIHWNNIRAGRNZ-UHFFFAOYSA-N
Compound name
4-methyl-2-(4-methylphenyl)pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

49
Patents

183.1048 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.11208 138.8
[M+Na]+ 206.09402 147.9
[M-H]- 182.09752 144.6
[M+NH4]+ 201.13862 157.6
[M+K]+ 222.06796 144.1
[M+H-H2O]+ 166.10206 131.3
[M+HCOO]- 228.10300 162.3
[M+CH3COO]- 242.11865 152.6
[M+Na-2H]- 204.07947 146.2
[M]+ 183.10425 138.8
[M]- 183.10535 138.8
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