CID 58487605

Methyl 3-hydroxypiperidine-3-carboxylate hydrochloride

Structural Information

Molecular Formula
C7H13NO3
SMILES
COC(=O)C1(CCCNC1)O
InChI
InChI=1S/C7H13NO3/c1-11-6(9)7(10)3-2-4-8-5-7/h8,10H,2-5H2,1H3
InChIKey
XTESLNLUWWTVGF-UHFFFAOYSA-N
Compound name
methyl 3-hydroxypiperidine-3-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

48
Patents

159.08954 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.096816 134.8
[M+Na]+ 182.078758 140.0
[M-H]- 158.082264 133.7
[M+NH4]+ 177.123363 154.5
[M+K]+ 198.052698 139.1
[M+H-H2O]+ 142.086800 129.7
[M+HCOO]- 204.087741 151.2
[M+CH3COO]- 218.103391 168.8
[M+Na-2H]- 180.064206 140.0
[M]+ 159.08899142 129.7
[M]- 159.09008858 129.7
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