CID 370207

Nsc642951

Structural Information

Molecular Formula
C17H13NO2
SMILES
COC1=CC=CC2=C1N=C(C=C2)C(=O)C3=CC=CC=C3
InChI
InChI=1S/C17H13NO2/c1-20-15-9-5-8-12-10-11-14(18-16(12)15)17(19)13-6-3-2-4-7-13/h2-11H,1H3
InChIKey
KPIGQDOHAUTNFS-UHFFFAOYSA-N
Compound name
(8-methoxyquinolin-2-yl)-phenylmethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

263.09464 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.10192 159.0
[M+Na]+ 286.08386 167.4
[M-H]- 262.08736 165.4
[M+NH4]+ 281.12846 174.9
[M+K]+ 302.05780 162.9
[M+H-H2O]+ 246.09190 150.1
[M+HCOO]- 308.09284 180.3
[M+CH3COO]- 322.10849 171.2
[M+Na-2H]- 284.06931 166.0
[M]+ 263.09409 160.5
[M]- 263.09519 160.5
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.