CID 10997480

Methyl 2,4-dioxopiperidine-3-carboxylate

Structural Information

Molecular Formula
C7H9NO4
SMILES
COC(=O)C1C(=O)CCNC1=O
InChI
InChI=1S/C7H9NO4/c1-12-7(11)5-4(9)2-3-8-6(5)10/h5H,2-3H2,1H3,(H,8,10)
InChIKey
DSWIHRDJTNMPEF-UHFFFAOYSA-N
Compound name
methyl 2,4-dioxopiperidine-3-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

27
Patents

171.05316 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 172.06044 134.9
[M+Na]+ 194.04238 144.3
[M+NH4]+ 189.08698 140.8
[M+K]+ 210.01632 140.9
[M-H]- 170.04588 133.5
[M+Na-2H]- 192.02783 137.3
[M]+ 171.05261 135.3
[M]- 171.05371 135.3
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