CID 5144559

4-amino-5-nitro-9h-fluoren-9-one

Structural Information

Molecular Formula
C13H8N2O3
SMILES
C1=CC2=C(C(=C1)N)C3=C(C2=O)C=CC=C3[N+](=O)[O-]
InChI
InChI=1S/C13H8N2O3/c14-9-5-1-3-7-11(9)12-8(13(7)16)4-2-6-10(12)15(17)18/h1-6H,14H2
InChIKey
BKGQKTNQMGETSA-UHFFFAOYSA-N
Compound name
4-amino-5-nitrofluoren-9-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

240.0535 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.06078 147.8
[M+Na]+ 263.04272 161.7
[M+NH4]+ 258.08732 156.9
[M+K]+ 279.01666 159.4
[M-H]- 239.04622 152.5
[M+Na-2H]- 261.02817 153.2
[M]+ 240.05295 150.9
[M]- 240.05405 150.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.