CID 19080

9-amino-6-chloro-2-methoxyacridine

Structural Information

Molecular Formula
C14H11ClN2O
SMILES
COC1=CC2=C(C3=C(C=C(C=C3)Cl)N=C2C=C1)N
InChI
InChI=1S/C14H11ClN2O/c1-18-9-3-5-12-11(7-9)14(16)10-4-2-8(15)6-13(10)17-12/h2-7H,1H3,(H2,16,17)
InChIKey
IHHSSHCBRVYGJX-UHFFFAOYSA-N
Compound name
6-chloro-2-methoxyacridin-9-amine
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

71
References

3990
Patents

258.056 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.06328 153.5
[M+Na]+ 281.04522 171.6
[M+NH4]+ 276.08982 163.9
[M+K]+ 297.01916 162.1
[M-H]- 257.04872 158.5
[M+Na-2H]- 279.03067 162.4
[M]+ 258.05545 158.1
[M]- 258.05655 158.1
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