CID 166527

80858-47-5

Structural Information

Molecular Formula
C14H20O
SMILES
C1CCC(CC1)OCCC2=CC=CC=C2
InChI
InChI=1S/C14H20O/c1-3-7-13(8-4-1)11-12-15-14-9-5-2-6-10-14/h1,3-4,7-8,14H,2,5-6,9-12H2
InChIKey
HLMIVULQFMULRM-UHFFFAOYSA-N
Compound name
2-cyclohexyloxyethylbenzene
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

282
Patents

204.15141 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.15869 149.1
[M+Na]+ 227.14063 161.9
[M+NH4]+ 222.18523 159.1
[M+K]+ 243.11457 153.2
[M-H]- 203.14413 154.3
[M+Na-2H]- 225.12608 157.7
[M]+ 204.15086 152.4
[M]- 204.15196 152.4
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