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]+ 174.11248 139.4
[M+Na]+ 196.09442 143.0
[M-H]- 172.09792 137.8
[M+NH4]+ 191.13902 156.4
[M+K]+ 212.06836 142.0
[M+H-H2O]+ 156.10246 133.3
[M+HCOO]- 218.10340 154.4
[M+CH3COO]- 232.11905 173.1
[M+Na-2H]- 194.07987 141.6
[M]+ 173.10465 133.6
[M]- 173.10575 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