CID 49759622

Ethyl 2-(2-oxopiperidin-4-yl)acetate

Structural Information

Molecular Formula
C9H15NO3
SMILES
CCOC(=O)CC1CCNC(=O)C1
InChI
InChI=1S/C9H15NO3/c1-2-13-9(12)6-7-3-4-10-8(11)5-7/h7H,2-6H2,1H3,(H,10,11)
InChIKey
SFBMPNSYLYPQDF-UHFFFAOYSA-N
Compound name
ethyl 2-(2-oxopiperidin-4-yl)acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

25
Patents

185.1052 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.112476 141.2
[M+Na]+ 208.094418 146.3
[M-H]- 184.097924 141.2
[M+NH4]+ 203.139023 158.7
[M+K]+ 224.068358 144.9
[M+H-H2O]+ 168.102460 134.9
[M+HCOO]- 230.103401 158.6
[M+CH3COO]- 244.119051 178.1
[M+Na-2H]- 206.079866 144.0
[M]+ 185.10465142 138.0
[M]- 185.10574858 138.0
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