CID 3065068

O-cresol, 4-cyclohexyl-alpha-morpholino-

Structural Information

Molecular Formula
C17H25NO2
SMILES
C1CCC(CC1)C2=CC(=C(C=C2)O)CN3CCOCC3
InChI
InChI=1S/C17H25NO2/c19-17-7-6-15(14-4-2-1-3-5-14)12-16(17)13-18-8-10-20-11-9-18/h6-7,12,14,19H,1-5,8-11,13H2
InChIKey
MGGFJPFEXXEOIM-UHFFFAOYSA-N
Compound name
4-cyclohexyl-2-(morpholin-4-ylmethyl)phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

275.18854 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 276.195816 167.3
[M+Na]+ 298.177758 169.2
[M-H]- 274.181264 172.9
[M+NH4]+ 293.222363 179.1
[M+K]+ 314.151698 166.2
[M+H-H2O]+ 258.185800 157.8
[M+HCOO]- 320.186741 180.0
[M+CH3COO]- 334.202391 175.9
[M+Na-2H]- 296.163206 168.9
[M]+ 275.18799142 159.0
[M]- 275.18908858 159.0
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.