CID 3070222

86002-63-3

Structural Information

Molecular Formula
C15H15N3
SMILES
CN1C(CN=C1C2=CC=NC=C2)C3=CC=CC=C3
InChI
InChI=1S/C15H15N3/c1-18-14(12-5-3-2-4-6-12)11-17-15(18)13-7-9-16-10-8-13/h2-10,14H,11H2,1H3
InChIKey
GDYUXMHMMKIJBG-UHFFFAOYSA-N
Compound name
4-(1-methyl-5-phenyl-4,5-dihydroimidazol-2-yl)pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

237.1266 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 238.133876 154.2
[M+Na]+ 260.115818 162.6
[M-H]- 236.119324 160.0
[M+NH4]+ 255.160423 169.2
[M+K]+ 276.089758 157.4
[M+H-H2O]+ 220.123860 143.9
[M+HCOO]- 282.124801 174.9
[M+CH3COO]- 296.140451 166.1
[M+Na-2H]- 258.101266 158.8
[M]+ 237.12605142 152.6
[M]- 237.12714858 152.6
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.