CID 3066070

2-(4-cyclohexylphenyl)-2,4-dimethylmorpholine hydrochloride

Structural Information

Molecular Formula
C18H27NO
SMILES
CC1(CN(CCO1)C)C2=CC=C(C=C2)C3CCCCC3
InChI
InChI=1S/C18H27NO/c1-18(14-19(2)12-13-20-18)17-10-8-16(9-11-17)15-6-4-3-5-7-15/h8-11,15H,3-7,12-14H2,1-2H3
InChIKey
IPQJWMUSGVVVOV-UHFFFAOYSA-N
Compound name
2-(4-cyclohexylphenyl)-2,4-dimethylmorpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

273.20926 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 274.21654 168.5
[M+Na]+ 296.19848 171.5
[M-H]- 272.20198 175.7
[M+NH4]+ 291.24308 183.2
[M+K]+ 312.17242 168.9
[M+H-H2O]+ 256.20652 158.9
[M+HCOO]- 318.20746 182.2
[M+CH3COO]- 332.22311 177.9
[M+Na-2H]- 294.18393 170.8
[M]+ 273.20871 161.1
[M]- 273.20981 161.1
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.