CID 3065065

4-cyclohexyl-alpha-(3,5-dimethylpiperidino)-o-cresol

Structural Information

Molecular Formula
C20H31NO
SMILES
CC1CC(CN(C1)CC2=C(C=CC(=C2)C3CCCCC3)O)C
InChI
InChI=1S/C20H31NO/c1-15-10-16(2)13-21(12-15)14-19-11-18(8-9-20(19)22)17-6-4-3-5-7-17/h8-9,11,15-17,22H,3-7,10,12-14H2,1-2H3
InChIKey
FYVHUDCCDVZFBU-UHFFFAOYSA-N
Compound name
4-cyclohexyl-2-[(3,5-dimethylpiperidin-1-yl)methyl]phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

301.24057 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 302.24785 177.5
[M+Na]+ 324.22979 179.9
[M-H]- 300.23329 182.7
[M+NH4]+ 319.27439 190.2
[M+K]+ 340.20373 174.7
[M+H-H2O]+ 284.23783 168.0
[M+HCOO]- 346.23877 189.8
[M+CH3COO]- 360.25442 204.8
[M+Na-2H]- 322.21524 175.3
[M]+ 301.24002 169.0
[M]- 301.24112 169.0
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

No patent data available for this compound.