CID 23391197

6flt

Structural Information

Molecular Formula
C24H24ClF
SMILES
CCCCCCC1=CC=C(C=C1)C2=C(C=C(C=C2)C3=CC=C(C=C3)Cl)F
InChI
InChI=1S/C24H24ClF/c1-2-3-4-5-6-18-7-9-20(10-8-18)23-16-13-21(17-24(23)26)19-11-14-22(25)15-12-19/h7-17H,2-6H2,1H3
InChIKey
RBOVYDXSFLMWTA-UHFFFAOYSA-N
Compound name
4-(4-chlorophenyl)-2-fluoro-1-(4-hexylphenyl)benzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

366.15506 Da
Monoisotopic Mass

8.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 367.16234 189.6
[M+Na]+ 389.14428 197.8
[M-H]- 365.14778 197.2
[M+NH4]+ 384.18888 202.9
[M+K]+ 405.11822 188.7
[M+H-H2O]+ 349.15232 179.5
[M+HCOO]- 411.15326 206.0
[M+CH3COO]- 425.16891 199.7
[M+Na-2H]- 387.12973 190.3
[M]+ 366.15451 192.2
[M]- 366.15561 192.2
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

patents stripe