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]+ 315.21074 178.0
[M+Na]+ 337.19268 180.5
[M-H]- 313.19618 188.5
[M+NH4]+ 332.23728 190.9
[M+K]+ 353.16662 173.7
[M+H-H2O]+ 297.20072 167.2
[M+HCOO]- 359.20166 195.6
[M+CH3COO]- 373.21731 187.0
[M+Na-2H]- 335.17813 179.6
[M]+ 314.20291 169.7
[M]- 314.20401 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.