CID 273212

1-phenyl-1-(2-quinolinyl)ethanol

Structural Information

Molecular Formula
C17H15NO
SMILES
CC(C1=CC=CC=C1)(C2=NC3=CC=CC=C3C=C2)O
InChI
InChI=1S/C17H15NO/c1-17(19,14-8-3-2-4-9-14)16-12-11-13-7-5-6-10-15(13)18-16/h2-12,19H,1H3
InChIKey
FKHUOZOQHSLAFU-UHFFFAOYSA-N
Compound name
1-phenyl-1-quinolin-2-ylethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

3
Patents

249.11537 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 250.12265 157.5
[M+Na]+ 272.10459 165.1
[M-H]- 248.10809 162.3
[M+NH4]+ 267.14919 173.4
[M+K]+ 288.07853 159.7
[M+H-H2O]+ 232.11263 149.5
[M+HCOO]- 294.11357 176.4
[M+CH3COO]- 308.12922 169.1
[M+Na-2H]- 270.09004 166.7
[M]+ 249.11482 156.2
[M]- 249.11592 156.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe