CID 98663

885-23-4

Structural Information

Molecular Formula
C14H9NO
SMILES
C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)C=O
InChI
InChI=1S/C14H9NO/c16-9-12-10-5-1-3-7-13(10)15-14-8-4-2-6-11(12)14/h1-9H
InChIKey
ISOCABSXIKQOOV-UHFFFAOYSA-N
Compound name
acridine-9-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

5
References

86
Patents

207.06842 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.075696 141.5
[M+Na]+ 230.057638 152.8
[M-H]- 206.061144 146.3
[M+NH4]+ 225.102243 161.4
[M+K]+ 246.031578 147.6
[M+H-H2O]+ 190.065680 134.0
[M+HCOO]- 252.066621 164.6
[M+CH3COO]- 266.082271 155.5
[M+Na-2H]- 228.043086 153.0
[M]+ 207.06787142 144.0
[M]- 207.06896858 144.0
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