CID 96394

Ethyl 4-hydroxypiperidine-1-carboxylate

Structural Information

Molecular Formula
C8H15NO3
SMILES
CCOC(=O)N1CCC(CC1)O
InChI
InChI=1S/C8H15NO3/c1-2-12-8(11)9-5-3-7(10)4-6-9/h7,10H,2-6H2,1H3
InChIKey
QABJNOSERNVHDY-UHFFFAOYSA-N
Compound name
ethyl 4-hydroxypiperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

232
Patents

173.1052 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.112476 138.3
[M+Na]+ 196.094418 143.6
[M-H]- 172.097924 138.5
[M+NH4]+ 191.139023 156.5
[M+K]+ 212.068358 143.1
[M+H-H2O]+ 156.102460 132.1
[M+HCOO]- 218.103401 155.9
[M+CH3COO]- 232.119051 175.3
[M+Na-2H]- 194.079866 141.6
[M]+ 173.10465142 135.4
[M]- 173.10574858 135.4
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