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]+ 276.19582 167.3
[M+Na]+ 298.17776 169.2
[M-H]- 274.18126 172.9
[M+NH4]+ 293.22236 179.1
[M+K]+ 314.15170 166.2
[M+H-H2O]+ 258.18580 157.8
[M+HCOO]- 320.18674 180.0
[M+CH3COO]- 334.20239 175.9
[M+Na-2H]- 296.16321 168.9
[M]+ 275.18799 159.0
[M]- 275.18909 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.