CID 30102

20304-70-5

Structural Information

Molecular Formula
C15H13N3O3
SMILES
CCOC1=CC2=C(C3=C(C=C(C=C3)[N+](=O)[O-])N=C2C=C1)N
InChI
InChI=1S/C15H13N3O3/c1-2-21-10-4-6-13-12(8-10)15(16)11-5-3-9(18(19)20)7-14(11)17-13/h3-8H,2H2,1H3,(H2,16,17)
InChIKey
NDKYICANXPTKKC-UHFFFAOYSA-N
Compound name
2-ethoxy-6-nitroacridin-9-amine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

6
Patents

283.0957 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 284.10298 159.9
[M+Na]+ 306.08492 168.9
[M-H]- 282.08842 164.3
[M+NH4]+ 301.12952 175.3
[M+K]+ 322.05886 160.5
[M+H-H2O]+ 266.09296 156.0
[M+HCOO]- 328.09390 183.5
[M+CH3COO]- 342.10955 199.4
[M+Na-2H]- 304.07037 170.3
[M]+ 283.09515 161.3
[M]- 283.09625 161.3
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