CID 43392874

Methyl 1-(3-hydroxypropyl)piperidine-4-carboxylate

Structural Information

Molecular Formula
C10H19NO3
SMILES
COC(=O)C1CCN(CC1)CCCO
InChI
InChI=1S/C10H19NO3/c1-14-10(13)9-3-6-11(7-4-9)5-2-8-12/h9,12H,2-8H2,1H3
InChIKey
JWESSHPBZLMQDB-UHFFFAOYSA-N
Compound name
methyl 1-(3-hydroxypropyl)piperidine-4-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

201.13649 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.14377 147.2
[M+Na]+ 224.12571 151.5
[M-H]- 200.12921 146.9
[M+NH4]+ 219.17031 164.1
[M+K]+ 240.09965 150.5
[M+H-H2O]+ 184.13375 140.6
[M+HCOO]- 246.13469 164.1
[M+CH3COO]- 260.15034 182.0
[M+Na-2H]- 222.11116 149.4
[M]+ 201.13594 145.1
[M]- 201.13704 145.1
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