CID 50989099

Methyl 2-hydroxy-2-(piperidin-4-yl)acetate hydrochloride

Structural Information

Molecular Formula
C8H15NO3
SMILES
COC(=O)C(C1CCNCC1)O
InChI
InChI=1S/C8H15NO3/c1-12-8(11)7(10)6-2-4-9-5-3-6/h6-7,9-10H,2-5H2,1H3
InChIKey
WPXBGWQJHVMQQG-UHFFFAOYSA-N
Compound name
methyl 2-hydroxy-2-piperidin-4-ylacetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

19
Patents

173.1052 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.112476 139.4
[M+Na]+ 196.094418 143.0
[M-H]- 172.097924 137.8
[M+NH4]+ 191.139023 156.4
[M+K]+ 212.068358 142.0
[M+H-H2O]+ 156.102460 133.3
[M+HCOO]- 218.103401 154.4
[M+CH3COO]- 232.119051 173.1
[M+Na-2H]- 194.079866 141.6
[M]+ 173.10465142 133.6
[M]- 173.10574858 133.6
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