CID 201867

7033-00-3

Structural Information

Molecular Formula
C12H19NO2
SMILES
C1CCN(CC1)C(CCO)C2=CC=CO2
InChI
InChI=1S/C12H19NO2/c14-9-6-11(12-5-4-10-15-12)13-7-2-1-3-8-13/h4-5,10-11,14H,1-3,6-9H2
InChIKey
SBLRONNKKPDPMY-UHFFFAOYSA-N
Compound name
3-(furan-2-yl)-3-piperidin-1-ylpropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

209.14159 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 210.14887 149.5
[M+Na]+ 232.13081 159.3
[M+NH4]+ 227.17541 157.4
[M+K]+ 248.10475 155.6
[M-H]- 208.13431 152.8
[M+Na-2H]- 230.11626 154.2
[M]+ 209.14104 151.6
[M]- 209.14214 151.6
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

No patent data available for this compound.