CID 5239140

7104-64-5

Structural Information

Molecular Formula
C24H26
SMILES
C1CCC(=CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)C4=CCCCC4
InChI
InChI=1S/C24H26/c1-3-7-19(8-4-1)21-11-15-23(16-12-21)24-17-13-22(14-18-24)20-9-5-2-6-10-20/h7,9,11-18H,1-6,8,10H2
InChIKey
SKNQGWYDAOIABF-UHFFFAOYSA-N
Compound name
1-(cyclohexen-1-yl)-4-[4-(cyclohexen-1-yl)phenyl]benzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

314.20346 Da
Monoisotopic Mass

7.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 315.210736 178.0
[M+Na]+ 337.192678 180.5
[M-H]- 313.196184 188.5
[M+NH4]+ 332.237283 190.9
[M+K]+ 353.166618 173.7
[M+H-H2O]+ 297.200720 167.2
[M+HCOO]- 359.201661 195.6
[M+CH3COO]- 373.217311 187.0
[M+Na-2H]- 335.178126 179.6
[M]+ 314.20291142 169.7
[M]- 314.20400858 169.7
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.