CID 22717992

Ethyl 4-hydroxypiperidine-4-carboxylate hydrochloride

Structural Information

Molecular Formula
C8H15NO3
SMILES
CCOC(=O)C1(CCNCC1)O
InChI
InChI=1S/C8H15NO3/c1-2-12-7(10)8(11)3-5-9-6-4-8/h9,11H,2-6H2,1H3
InChIKey
WEJQDOQJHKHPNU-UHFFFAOYSA-N
Compound name
ethyl 4-hydroxypiperidine-4-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

60
Patents

173.1052 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.11248 139.2
[M+Na]+ 196.09442 144.0
[M-H]- 172.09792 138.0
[M+NH4]+ 191.13902 158.4
[M+K]+ 212.06836 142.9
[M+H-H2O]+ 156.10246 134.0
[M+HCOO]- 218.10340 155.3
[M+CH3COO]- 232.11905 171.8
[M+Na-2H]- 194.07987 143.9
[M]+ 173.10465 134.5
[M]- 173.10575 134.5
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