CID 12654990

Methyl 4-hydroxypiperidine-1-carboxyl

Structural Information

Molecular Formula
C7H13NO3
SMILES
COC(=O)N1CCC(CC1)O
InChI
InChI=1S/C7H13NO3/c1-11-7(10)8-4-2-6(9)3-5-8/h6,9H,2-5H2,1H3
InChIKey
AACMIVJLZDJLSX-UHFFFAOYSA-N
Compound name
methyl 4-hydroxypiperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

81
Patents

159.08954 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.096816 133.7
[M+Na]+ 182.078758 139.5
[M-H]- 158.082264 134.1
[M+NH4]+ 177.123363 152.5
[M+K]+ 198.052698 139.2
[M+H-H2O]+ 142.086800 127.8
[M+HCOO]- 204.087741 151.7
[M+CH3COO]- 218.103391 172.2
[M+Na-2H]- 180.064206 137.6
[M]+ 159.08899142 130.5
[M]- 159.09008858 130.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe