CID 96270

9-acetamidoacridine

Structural Information

Molecular Formula
C15H12N2O
SMILES
CC(=O)NC1=C2C=CC=CC2=NC3=CC=CC=C31
InChI
InChI=1S/C15H12N2O/c1-10(18)16-15-11-6-2-4-8-13(11)17-14-9-5-3-7-12(14)15/h2-9H,1H3,(H,16,17,18)
InChIKey
QBRHXTCIXTXYEV-UHFFFAOYSA-N
Compound name
N-acridin-9-ylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

300
Patents

236.09496 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 237.10224 150.2
[M+Na]+ 259.08418 159.8
[M-H]- 235.08768 154.8
[M+NH4]+ 254.12878 168.5
[M+K]+ 275.05812 154.9
[M+H-H2O]+ 219.09222 142.3
[M+HCOO]- 281.09316 172.9
[M+CH3COO]- 295.10881 163.1
[M+Na-2H]- 257.06963 160.5
[M]+ 236.09441 151.7
[M]- 236.09551 151.7
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

patents stripe