CID 24844762

102612-58-8

Structural Information

Molecular Formula
C24H30N2
SMILES
CC1=CC(=[N+](C(=C1)C)CC2=CC=C(C=C2)C[N+]3=C(C=C(C=C3C)C)C)C
InChI
InChI=1S/C24H30N2/c1-17-11-19(3)25(20(4)12-17)15-23-7-9-24(10-8-23)16-26-21(5)13-18(2)14-22(26)6/h7-14H,15-16H2,1-6H3/q+2
InChIKey
DQCHBJNNPAAVSA-UHFFFAOYSA-N
Compound name
2,4,6-trimethyl-1-[[4-[(2,4,6-trimethylpyridin-1-ium-1-yl)methyl]phenyl]methyl]pyridin-1-ium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

346.2409 Da
Monoisotopic Mass

5.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 347.24818 195.4
[M+Na]+ 369.23012 204.5
[M-H]- 345.23362 203.4
[M+NH4]+ 364.27472 206.1
[M+K]+ 385.20406 186.7
[M+H-H2O]+ 329.23816 189.8
[M+HCOO]- 391.23910 213.5
[M+CH3COO]- 405.25475 208.7
[M+Na-2H]- 367.21557 199.4
[M]+ 346.24035 196.3
[M]- 346.24145 196.3
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.