CID 3066068

109461-34-9

Structural Information

Molecular Formula
C24H33NO
SMILES
CC(C)N1CCOC(C1)(C)C2=CC=C(C3=CC=CC=C32)C4CCCCC4
InChI
InChI=1S/C24H33NO/c1-18(2)25-15-16-26-24(3,17-25)23-14-13-20(19-9-5-4-6-10-19)21-11-7-8-12-22(21)23/h7-8,11-14,18-19H,4-6,9-10,15-17H2,1-3H3
InChIKey
UQAJUVYFKKPNLZ-UHFFFAOYSA-N
Compound name
2-(4-cyclohexylnaphthalen-1-yl)-2-methyl-4-propan-2-ylmorpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

351.25623 Da
Monoisotopic Mass

6.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 352.263506 190.6
[M+Na]+ 374.245448 192.9
[M-H]- 350.248954 198.0
[M+NH4]+ 369.290053 202.8
[M+K]+ 390.219388 188.7
[M+H-H2O]+ 334.253490 179.4
[M+HCOO]- 396.254431 200.7
[M+CH3COO]- 410.270081 198.0
[M+Na-2H]- 372.230896 190.4
[M]+ 351.25568142 183.4
[M]- 351.25677858 183.4
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.