CID 25220468

1158610-82-2

Structural Information

Molecular Formula
C11H19NO3
SMILES
C1CN(CCC1C(=O)O)C2CCOCC2
InChI
InChI=1S/C11H19NO3/c13-11(14)9-1-5-12(6-2-9)10-3-7-15-8-4-10/h9-10H,1-8H2,(H,13,14)
InChIKey
XZSJNHBRVLLOCT-UHFFFAOYSA-N
Compound name
1-(oxan-4-yl)piperidine-4-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

23
Patents

213.13649 Da
Monoisotopic Mass

-1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.14377 149.6
[M+Na]+ 236.12571 151.7
[M-H]- 212.12921 152.4
[M+NH4]+ 231.17031 163.9
[M+K]+ 252.09965 151.2
[M+H-H2O]+ 196.13375 141.9
[M+HCOO]- 258.13469 162.3
[M+CH3COO]- 272.15034 182.7
[M+Na-2H]- 234.11116 151.6
[M]+ 213.13594 141.6
[M]- 213.13704 141.6
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