CID 44230126

1176202-62-2

Structural Information

Molecular Formula
C20H25N2
SMILES
CC1=CC=CC2=C[N+](=CN12)C3=C(C=CC=C3C(C)C)C(C)C
InChI
InChI=1S/C20H25N2/c1-14(2)18-10-7-11-19(15(3)4)20(18)21-12-17-9-6-8-16(5)22(17)13-21/h6-15H,1-5H3/q+1
InChIKey
IAZDBMHWYCUELA-UHFFFAOYSA-N
Compound name
2-[2,6-di(propan-2-yl)phenyl]-5-methylimidazo[1,5-a]pyridin-2-ium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

293.20178 Da
Monoisotopic Mass

6.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 294.20906 174.8
[M+Na]+ 316.19100 183.9
[M-H]- 292.19450 180.8
[M+NH4]+ 311.23560 190.7
[M+K]+ 332.16494 173.1
[M+H-H2O]+ 276.19904 168.8
[M+HCOO]- 338.19998 194.0
[M+CH3COO]- 352.21563 202.1
[M+Na-2H]- 314.17645 177.9
[M]+ 293.20123 177.0
[M]- 293.20233 177.0
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