CID 135534382

Pyridinium, 2-(2-(8-hydroxy-2-quinolyl)vinyl)-1-methyl-, chloride

Structural Information

Molecular Formula
C17H15N2O
SMILES
C[N+]1=CC=CC=C1/C=C/C2=NC3=C(C=CC=C3O)C=C2
InChI
InChI=1S/C17H14N2O/c1-19-12-3-2-6-15(19)11-10-14-9-8-13-5-4-7-16(20)17(13)18-14/h2-12H,1H3/p+1
InChIKey
HWDNIHCOUPOQHL-UHFFFAOYSA-O
Compound name
2-[(E)-2-(1-methylpyridin-1-ium-2-yl)ethenyl]quinolin-8-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

263.11844 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.12572 159.7
[M+Na]+ 286.10766 178.9
[M+NH4]+ 281.15226 169.5
[M+K]+ 302.08160 170.1
[M-H]- 262.11116 166.0
[M+Na-2H]- 284.09311 170.4
[M]+ 263.11789 164.8
[M]- 263.11899 164.8
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.