CID 4115492

9-cyclohexyl-9-methylfluorene

Structural Information

Molecular Formula
C20H22
SMILES
CC1(C2=CC=CC=C2C3=CC=CC=C31)C4CCCCC4
InChI
InChI=1S/C20H22/c1-20(15-9-3-2-4-10-15)18-13-7-5-11-16(18)17-12-6-8-14-19(17)20/h5-8,11-15H,2-4,9-10H2,1H3
InChIKey
LSLMRJQHMXQNEF-UHFFFAOYSA-N
Compound name
9-cyclohexyl-9-methylfluorene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

262.17215 Da
Monoisotopic Mass

6.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.17943 164.2
[M+Na]+ 285.16137 170.9
[M-H]- 261.16487 172.0
[M+NH4]+ 280.20597 186.4
[M+K]+ 301.13531 164.5
[M+H-H2O]+ 245.16941 156.3
[M+HCOO]- 307.17035 182.6
[M+CH3COO]- 321.18600 175.7
[M+Na-2H]- 283.14682 168.1
[M]+ 262.17160 160.0
[M]- 262.17270 160.0
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