CID 71013

9-chloroacridine

Structural Information

Molecular Formula
C13H8ClN
SMILES
C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)Cl
InChI
InChI=1S/C13H8ClN/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1-8H
InChIKey
BPXINCHFOLVVSG-UHFFFAOYSA-N
Compound name
9-chloroacridine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

13
References

482
Patents

213.03453 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.04181 141.1
[M+Na]+ 236.02375 160.7
[M+NH4]+ 231.06835 152.9
[M+K]+ 251.99769 150.0
[M-H]- 212.02725 146.4
[M+Na-2H]- 234.00920 152.1
[M]+ 213.03398 146.2
[M]- 213.03508 146.2
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