CID 3048442

Pyridinium, 4-(diphenylmethyl)-1-(3-(trimethylammonio)propyl)-, dibromide

Structural Information

Molecular Formula
C24H30N2
SMILES
C[N+](C)(C)CCC[N+]1=CC=C(C=C1)C(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C24H30N2/c1-26(2,3)20-10-17-25-18-15-23(16-19-25)24(21-11-6-4-7-12-21)22-13-8-5-9-14-22/h4-9,11-16,18-19,24H,10,17,20H2,1-3H3/q+2
InChIKey
BLGKLJDNWAPCDE-UHFFFAOYSA-N
Compound name
3-(4-benzhydrylpyridin-1-ium-1-yl)propyl-trimethylazanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

346.2409 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 347.24818 191.9
[M+Na]+ 369.23012 195.1
[M-H]- 345.23362 200.5
[M+NH4]+ 364.27472 202.6
[M+K]+ 385.20406 178.8
[M+H-H2O]+ 329.23816 186.3
[M+HCOO]- 391.23910 211.1
[M+CH3COO]- 405.25475 207.8
[M+Na-2H]- 367.21557 200.6
[M]+ 346.24035 189.6
[M]- 346.24145 189.6
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.