CID 16783651

4-(4-hydroxypiperidin-1-yl)-4-oxobutanoic acid

Structural Information

Molecular Formula
C9H15NO4
SMILES
C1CN(CCC1O)C(=O)CCC(=O)O
InChI
InChI=1S/C9H15NO4/c11-7-3-5-10(6-4-7)8(12)1-2-9(13)14/h7,11H,1-6H2,(H,13,14)
InChIKey
REGMPDHPYKTLDU-UHFFFAOYSA-N
Compound name
4-(4-hydroxypiperidin-1-yl)-4-oxobutanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

201.10011 Da
Monoisotopic Mass

-1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.10739 145.0
[M+Na]+ 224.08933 152.7
[M+NH4]+ 219.13393 150.3
[M+K]+ 240.06327 149.8
[M-H]- 200.09283 142.9
[M+Na-2H]- 222.07478 146.2
[M]+ 201.09956 144.8
[M]- 201.10066 144.8
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