CID 103049

Phenol, 2-(1-ethylcyclopentyl)-4,6-dimethyl-

Structural Information

Molecular Formula
C15H22O
SMILES
CCC1(CCCC1)C2=CC(=CC(=C2O)C)C
InChI
InChI=1S/C15H22O/c1-4-15(7-5-6-8-15)13-10-11(2)9-12(3)14(13)16/h9-10,16H,4-8H2,1-3H3
InChIKey
JEDRDNRBDGFAHS-UHFFFAOYSA-N
Compound name
2-(1-ethylcyclopentyl)-4,6-dimethylphenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

218.16707 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.17435 152.1
[M+Na]+ 241.15629 164.3
[M+NH4]+ 236.20089 162.8
[M+K]+ 257.13023 156.7
[M-H]- 217.15979 156.1
[M+Na-2H]- 239.14174 159.8
[M]+ 218.16652 155.1
[M]- 218.16762 155.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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No literature data available for this compound.

Patent stripe

No patent data available for this compound.