CID 19936653

1-methoxypiperidin-4-one

Structural Information

Molecular Formula
C6H11NO2
SMILES
CON1CCC(=O)CC1
InChI
InChI=1S/C6H11NO2/c1-9-7-4-2-6(8)3-5-7/h2-5H2,1H3
InChIKey
GWMISASZFLPFMP-UHFFFAOYSA-N
Compound name
1-methoxypiperidin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

160
Patents

129.07898 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.086256 124.8
[M+Na]+ 152.068198 131.5
[M-H]- 128.071704 126.7
[M+NH4]+ 147.112803 145.5
[M+K]+ 168.042138 131.5
[M+H-H2O]+ 112.076240 118.8
[M+HCOO]- 174.077181 145.4
[M+CH3COO]- 188.092831 170.2
[M+Na-2H]- 150.053646 131.0
[M]+ 129.07843142 122.4
[M]- 129.07952858 122.4
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

patents stripe