CID 3051478

1-(4-indanyloxy)-3-piperidino-2-propanol

Structural Information

Molecular Formula
C17H25NO2
SMILES
C1CCN(CC1)CC(COC2=CC=CC3=C2CCC3)O
InChI
InChI=1S/C17H25NO2/c19-15(12-18-10-2-1-3-11-18)13-20-17-9-5-7-14-6-4-8-16(14)17/h5,7,9,15,19H,1-4,6,8,10-13H2
InChIKey
OSQXNJFIVXOZLL-UHFFFAOYSA-N
Compound name
1-(2,3-dihydro-1H-inden-4-yloxy)-3-piperidin-1-ylpropan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

275.18854 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 276.195816 167.1
[M+Na]+ 298.177758 169.5
[M-H]- 274.181264 170.1
[M+NH4]+ 293.222363 183.2
[M+K]+ 314.151698 165.7
[M+H-H2O]+ 258.185800 158.9
[M+HCOO]- 320.186741 181.8
[M+CH3COO]- 334.202391 196.0
[M+Na-2H]- 296.163206 167.5
[M]+ 275.18799142 162.2
[M]- 275.18908858 162.2
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.