CID 3050377

Brn 0429183

Structural Information

Molecular Formula
C20H18N2O
SMILES
CN1C2=CC=CC=C2C(C3=CC=CC=C31)C4=C(C=C(C=C4)N)O
InChI
InChI=1S/C20H18N2O/c1-22-17-8-4-2-6-14(17)20(15-7-3-5-9-18(15)22)16-11-10-13(21)12-19(16)23/h2-12,20,23H,21H2,1H3
InChIKey
LRLZTCODJIWNOL-UHFFFAOYSA-N
Compound name
5-amino-2-(10-methyl-9H-acridin-9-yl)phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

302.1419 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 303.14918 171.9
[M+Na]+ 325.13112 180.9
[M-H]- 301.13462 177.6
[M+NH4]+ 320.17572 186.7
[M+K]+ 341.10506 173.7
[M+H-H2O]+ 285.13916 162.8
[M+HCOO]- 347.14010 189.8
[M+CH3COO]- 361.15575 182.5
[M+Na-2H]- 323.11657 177.4
[M]+ 302.14135 169.4
[M]- 302.14245 169.4
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.