CID 566665

6-methoxypiperidin-2-one

Structural Information

Molecular Formula
C6H11NO2
SMILES
COC1CCCC(=O)N1
InChI
InChI=1S/C6H11NO2/c1-9-6-4-2-3-5(8)7-6/h6H,2-4H2,1H3,(H,7,8)
InChIKey
GHUQMJJLFXGPEJ-UHFFFAOYSA-N
Compound name
6-methoxypiperidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

129.07898 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.08626 125.8
[M+Na]+ 152.06820 132.1
[M-H]- 128.07170 126.2
[M+NH4]+ 147.11280 145.7
[M+K]+ 168.04214 131.1
[M+H-H2O]+ 112.07624 120.1
[M+HCOO]- 174.07718 144.8
[M+CH3COO]- 188.09283 167.6
[M+Na-2H]- 150.05365 131.4
[M]+ 129.07843 121.5
[M]- 129.07953 121.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe