CID 5465790

Nsc662135

Structural Information

Molecular Formula
C14H11NO3
SMILES
CC1=C2C(=CC=C1)NC3=C(C2=O)C(=CC(=C3)O)O
InChI
InChI=1S/C14H11NO3/c1-7-3-2-4-9-12(7)14(18)13-10(15-9)5-8(16)6-11(13)17/h2-6,16-17H,1H3,(H,15,18)
InChIKey
JCBDAFIHZKTUHH-UHFFFAOYSA-N
Compound name
1,3-dihydroxy-8-methyl-10H-acridin-9-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

0
Patents

241.0739 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.08118 150.1
[M+Na]+ 264.06312 162.5
[M-H]- 240.06662 152.0
[M+NH4]+ 259.10772 167.3
[M+K]+ 280.03706 156.3
[M+H-H2O]+ 224.07116 143.8
[M+HCOO]- 286.07210 168.9
[M+CH3COO]- 300.08775 162.8
[M+Na-2H]- 262.04857 158.1
[M]+ 241.07335 151.4
[M]- 241.07445 151.4
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.