CID 53296

9-(o-toluidino)acridine hydrochloride

Structural Information

Molecular Formula
C20H16N2
SMILES
CC1=CC=CC=C1NC2=C3C=CC=CC3=NC4=CC=CC=C42
InChI
InChI=1S/C20H16N2/c1-14-8-2-5-11-17(14)22-20-15-9-3-6-12-18(15)21-19-13-7-4-10-16(19)20/h2-13H,1H3,(H,21,22)
InChIKey
XHEJSUGYAUCWQH-UHFFFAOYSA-N
Compound name
N-(2-methylphenyl)acridin-9-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

284.13135 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.13863 165.3
[M+Na]+ 307.12057 175.0
[M-H]- 283.12407 172.7
[M+NH4]+ 302.16517 181.3
[M+K]+ 323.09451 167.7
[M+H-H2O]+ 267.12861 155.6
[M+HCOO]- 329.12955 188.0
[M+CH3COO]- 343.14520 177.3
[M+Na-2H]- 305.10602 175.6
[M]+ 284.13080 166.0
[M]- 284.13190 166.0
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

No patent data available for this compound.