CID 45362

2-(p-cyclohexyldiphenylmethoxy)-n,n-dimethylethylamine hydrochloride

Structural Information

Molecular Formula
C23H31NO
SMILES
CN(C)CCOC(C1=CC=CC=C1)C2=CC=C(C=C2)C3CCCCC3
InChI
InChI=1S/C23H31NO/c1-24(2)17-18-25-23(21-11-7-4-8-12-21)22-15-13-20(14-16-22)19-9-5-3-6-10-19/h4,7-8,11-16,19,23H,3,5-6,9-10,17-18H2,1-2H3
InChIKey
LWGJVAZAKSHKBZ-UHFFFAOYSA-N
Compound name
2-[(4-cyclohexylphenyl)-phenylmethoxy]-N,N-dimethylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

337.24057 Da
Monoisotopic Mass

5.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 338.24785 185.4
[M+Na]+ 360.22979 185.9
[M-H]- 336.23329 194.0
[M+NH4]+ 355.27439 198.0
[M+K]+ 376.20373 182.3
[M+H-H2O]+ 320.23783 175.0
[M+HCOO]- 382.23877 204.3
[M+CH3COO]- 396.25442 218.0
[M+Na-2H]- 358.21524 185.6
[M]+ 337.24002 182.1
[M]- 337.24112 182.1
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.