CID 611151

81793-57-9

Structural Information

Molecular Formula
C20H23F
SMILES
CCC1CCC(CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)F
InChI
InChI=1S/C20H23F/c1-2-15-3-5-16(6-4-15)17-7-9-18(10-8-17)19-11-13-20(21)14-12-19/h7-16H,2-6H2,1H3
InChIKey
XDMMLICZIBJWLM-UHFFFAOYSA-N
Compound name
1-(4-ethylcyclohexyl)-4-(4-fluorophenyl)benzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

145
Patents

282.17838 Da
Monoisotopic Mass

7.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 283.18566 167.8
[M+Na]+ 305.16760 173.0
[M-H]- 281.17110 175.2
[M+NH4]+ 300.21220 183.3
[M+K]+ 321.14154 167.1
[M+H-H2O]+ 265.17564 158.1
[M+HCOO]- 327.17658 186.1
[M+CH3COO]- 341.19223 178.2
[M+Na-2H]- 303.15305 169.1
[M]+ 282.17783 162.0
[M]- 282.17893 162.0
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