CID 54688509

Nsc282464

Structural Information

Molecular Formula
C15H13NO4
SMILES
COC1=C(C2=CC3=C(C=C2C=C1)NC(=O)C=C3O)OC
InChI
InChI=1S/C15H13NO4/c1-19-13-4-3-8-5-11-10(6-9(8)15(13)20-2)12(17)7-14(18)16-11/h3-7H,1-2H3,(H2,16,17,18)
InChIKey
UZGGITVTWKKMDQ-UHFFFAOYSA-N
Compound name
4-hydroxy-6,7-dimethoxy-1H-benzo[g]quinolin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

271.08447 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 272.09175 157.4
[M+Na]+ 294.07369 169.5
[M-H]- 270.07719 160.4
[M+NH4]+ 289.11829 173.9
[M+K]+ 310.04763 164.6
[M+H-H2O]+ 254.08173 150.2
[M+HCOO]- 316.08267 177.4
[M+CH3COO]- 330.09832 195.8
[M+Na-2H]- 292.05914 165.4
[M]+ 271.08392 162.2
[M]- 271.08502 162.2
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.