CID 97046955

1208220-06-7

Structural Information

Molecular Formula
C35H39N2
SMILES
C1CCC(CC1)C2=C(C3=CC=CC=C3C=C2)N4CC[N+](=C4)C5=C(C=CC6=CC=CC=C65)C7CCCCC7
InChI
InChI=1S/C35H39N2/c1-3-11-26(12-4-1)32-21-19-28-15-7-9-17-30(28)34(32)36-23-24-37(25-36)35-31-18-10-8-16-29(31)20-22-33(35)27-13-5-2-6-14-27/h7-10,15-22,25-27H,1-6,11-14,23-24H2/q+1
InChIKey
PYEMDUXCDVVCEN-UHFFFAOYSA-N
Compound name
1,3-bis(2-cyclohexylnaphthalen-1-yl)-4,5-dihydroimidazol-1-ium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

487.3113 Da
Monoisotopic Mass

10.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 488.31858 226.7
[M+Na]+ 510.30052 246.3
[M+NH4]+ 505.34512 238.2
[M+K]+ 526.27446 235.0
[M-H]- 486.30402 240.5
[M+Na-2H]- 508.28597 238.2
[M]+ 487.31075 234.2
[M]- 487.31185 234.2
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.