CID 174293

82991-47-7

Structural Information

Molecular Formula
C17H26
SMILES
CCCC1CCC(CC1)C2=CC=C(C=C2)CC
InChI
InChI=1S/C17H26/c1-3-5-15-8-12-17(13-9-15)16-10-6-14(4-2)7-11-16/h6-7,10-11,15,17H,3-5,8-9,12-13H2,1-2H3
InChIKey
OYOBZVHPZUVLSF-UHFFFAOYSA-N
Compound name
1-ethyl-4-(4-propylcyclohexyl)benzene
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

219
Patents

230.20345 Da
Monoisotopic Mass

6.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.21073 158.3
[M+Na]+ 253.19267 171.7
[M+NH4]+ 248.23727 168.4
[M+K]+ 269.16661 162.2
[M-H]- 229.19617 164.0
[M+Na-2H]- 251.17812 166.2
[M]+ 230.20290 162.0
[M]- 230.20400 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