CID 19834728

2-cyclohexylbiphenyl

Structural Information

Molecular Formula
C18H20
SMILES
C1CCC(CC1)C2=CC=CC=C2C3=CC=CC=C3
InChI
InChI=1S/C18H20/c1-3-9-15(10-4-1)17-13-7-8-14-18(17)16-11-5-2-6-12-16/h1,3-4,7-10,13-14,16H,2,5-6,11-12H2
InChIKey
GRZJZRHVJAXMRR-UHFFFAOYSA-N
Compound name
1-cyclohexyl-2-phenylbenzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

5593
Patents

236.1565 Da
Monoisotopic Mass

6.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 237.16378 155.4
[M+Na]+ 259.14572 159.5
[M-H]- 235.14922 163.8
[M+NH4]+ 254.19032 172.2
[M+K]+ 275.11966 154.5
[M+H-H2O]+ 219.15376 146.8
[M+HCOO]- 281.15470 175.5
[M+CH3COO]- 295.17035 166.6
[M+Na-2H]- 257.13117 160.0
[M]+ 236.15595 149.1
[M]- 236.15705 149.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe