CID 15953947

Chembl485089

Structural Information

Molecular Formula
C18H16N2O3
SMILES
C1COCCN1C(=O)C2=CC=CC3=C2NC4=CC=CC=C4C3=O
InChI
InChI=1S/C18H16N2O3/c21-17-12-4-1-2-7-15(12)19-16-13(17)5-3-6-14(16)18(22)20-8-10-23-11-9-20/h1-7H,8-11H2,(H,19,21)
InChIKey
SSNQWEYMQYHSFZ-UHFFFAOYSA-N
Compound name
4-(morpholine-4-carbonyl)-10H-acridin-9-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

308.1161 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 309.12338 169.5
[M+Na]+ 331.10532 177.4
[M-H]- 307.10882 174.2
[M+NH4]+ 326.14992 180.9
[M+K]+ 347.07926 172.4
[M+H-H2O]+ 291.11336 159.3
[M+HCOO]- 353.11430 183.6
[M+CH3COO]- 367.12995 179.4
[M+Na-2H]- 329.09077 176.2
[M]+ 308.11555 167.4
[M]- 308.11665 167.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.