CID 59238644

4-methyl-4-(morpholin-4-yl)cyclohexan-1-one

Structural Information

Molecular Formula
C11H19NO2
SMILES
CC1(CCC(=O)CC1)N2CCOCC2
InChI
InChI=1S/C11H19NO2/c1-11(4-2-10(13)3-5-11)12-6-8-14-9-7-12/h2-9H2,1H3
InChIKey
GPCBTAQXTZJOFF-UHFFFAOYSA-N
Compound name
4-methyl-4-morpholin-4-ylcyclohexan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

197.14159 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.14887 145.6
[M+Na]+ 220.13081 149.5
[M-H]- 196.13431 150.2
[M+NH4]+ 215.17541 163.6
[M+K]+ 236.10475 149.3
[M+H-H2O]+ 180.13885 138.3
[M+HCOO]- 242.13979 160.7
[M+CH3COO]- 256.15544 181.7
[M+Na-2H]- 218.11626 150.4
[M]+ 197.14104 139.0
[M]- 197.14214 139.0
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

patents stripe