CID 3080014

Brn 4438446

Structural Information

Molecular Formula
C16H20N2O
SMILES
C1CCN(CC1)CC(C2=NC3=CC=CC=C3C=C2)O
InChI
InChI=1S/C16H20N2O/c19-16(12-18-10-4-1-5-11-18)15-9-8-13-6-2-3-7-14(13)17-15/h2-3,6-9,16,19H,1,4-5,10-12H2
InChIKey
WRYOEBSWRAKPGB-UHFFFAOYSA-N
Compound name
2-piperidin-1-yl-1-quinolin-2-ylethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

256.15756 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.16484 160.5
[M+Na]+ 279.14678 164.6
[M-H]- 255.15028 162.5
[M+NH4]+ 274.19138 174.2
[M+K]+ 295.12072 159.8
[M+H-H2O]+ 239.15482 151.0
[M+HCOO]- 301.15576 174.6
[M+CH3COO]- 315.17141 169.7
[M+Na-2H]- 277.13223 165.3
[M]+ 256.15701 154.9
[M]- 256.15811 154.9
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.