CID 135611794

3-acridinol

Structural Information

Molecular Formula
C13H9NO
SMILES
C1=CC=C2C(=C1)C=C3C=CC(=CC3=N2)O
InChI
InChI=1S/C13H9NO/c15-11-6-5-10-7-9-3-1-2-4-12(9)14-13(10)8-11/h1-8,15H
InChIKey
PCQLWQDFGQKOAO-UHFFFAOYSA-N
Compound name
acridin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

258
Patents

195.06842 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.075696 138.0
[M+Na]+ 218.057638 149.1
[M-H]- 194.061144 141.7
[M+NH4]+ 213.102243 157.9
[M+K]+ 234.031578 143.9
[M+H-H2O]+ 178.065680 131.1
[M+HCOO]- 240.066621 159.8
[M+CH3COO]- 254.082271 151.8
[M+Na-2H]- 216.043086 149.8
[M]+ 195.06787142 139.2
[M]- 195.06896858 139.2
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

patents stripe