CID 26671

9-(o-chloroanilino)acridine hydrochloride

Structural Information

Molecular Formula
C19H13ClN2
SMILES
C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)NC4=CC=CC=C4Cl
InChI
InChI=1S/C19H13ClN2/c20-15-9-3-6-12-18(15)22-19-13-7-1-4-10-16(13)21-17-11-5-2-8-14(17)19/h1-12H,(H,21,22)
InChIKey
JWJNRFPYXGTVPU-UHFFFAOYSA-N
Compound name
N-(2-chlorophenyl)acridin-9-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

304.07672 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 305.08400 167.5
[M+Na]+ 327.06594 178.5
[M-H]- 303.06944 174.7
[M+NH4]+ 322.11054 183.6
[M+K]+ 343.03988 170.0
[M+H-H2O]+ 287.07398 158.4
[M+HCOO]- 349.07492 186.0
[M+CH3COO]- 363.09057 179.5
[M+Na-2H]- 325.05139 177.8
[M]+ 304.07617 170.4
[M]- 304.07727 170.4
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.