CID 370174

Nsc642918

Structural Information

Molecular Formula
C17H13NO2
SMILES
CN1C2=C(C=CC1=O)C=C(C=C2)C(=O)C3=CC=CC=C3
InChI
InChI=1S/C17H13NO2/c1-18-15-9-7-14(11-13(15)8-10-16(18)19)17(20)12-5-3-2-4-6-12/h2-11H,1H3
InChIKey
RNQWABMODVGKRW-UHFFFAOYSA-N
Compound name
6-benzoyl-1-methylquinolin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

263.09464 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.10192 158.1
[M+Na]+ 286.08386 167.7
[M-H]- 262.08736 164.9
[M+NH4]+ 281.12846 174.3
[M+K]+ 302.05780 162.6
[M+H-H2O]+ 246.09190 149.4
[M+HCOO]- 308.09284 179.6
[M+CH3COO]- 322.10849 170.7
[M+Na-2H]- 284.06931 164.4
[M]+ 263.09409 159.3
[M]- 263.09519 159.3
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.