CID 40666

53207-41-3

Structural Information

Molecular Formula
C19H31NO
SMILES
CC(C)(CN(C)C)C(C1=CC=C(C=C1)C2CCCCC2)O
InChI
InChI=1S/C19H31NO/c1-19(2,14-20(3)4)18(21)17-12-10-16(11-13-17)15-8-6-5-7-9-15/h10-13,15,18,21H,5-9,14H2,1-4H3
InChIKey
SPYDSHBXCCMSOI-UHFFFAOYSA-N
Compound name
1-(4-cyclohexylphenyl)-3-(dimethylamino)-2,2-dimethylpropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

289.24057 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 290.24785 174.0
[M+Na]+ 312.22979 183.8
[M+NH4]+ 307.27439 182.2
[M+K]+ 328.20373 177.5
[M-H]- 288.23329 178.2
[M+Na-2H]- 310.21524 180.1
[M]+ 289.24002 176.6
[M]- 289.24112 176.6
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.