CID 2724174

2-methylacridine-9-carbaldehyde

Structural Information

Molecular Formula
C15H11NO
SMILES
CC1=CC2=C(C3=CC=CC=C3N=C2C=C1)C=O
InChI
InChI=1S/C15H11NO/c1-10-6-7-15-12(8-10)13(9-17)11-4-2-3-5-14(11)16-15/h2-9H,1H3
InChIKey
PIBZGMVFXCKDER-UHFFFAOYSA-N
Compound name
2-methylacridine-9-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

21
Patents

221.08406 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 222.09134 146.4
[M+Na]+ 244.07328 158.1
[M-H]- 220.07678 151.4
[M+NH4]+ 239.11788 166.0
[M+K]+ 260.04722 152.7
[M+H-H2O]+ 204.08132 138.8
[M+HCOO]- 266.08226 169.1
[M+CH3COO]- 280.09791 160.3
[M+Na-2H]- 242.05873 156.6
[M]+ 221.08351 149.6
[M]- 221.08461 149.6
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