CID 235271

3-amino-9-fluorenone

Structural Information

Molecular Formula
C13H9NO
SMILES
C1=CC=C2C(=C1)C3=C(C2=O)C=CC(=C3)N
InChI
InChI=1S/C13H9NO/c14-8-5-6-11-12(7-8)9-3-1-2-4-10(9)13(11)15/h1-7H,14H2
InChIKey
POZGQVDLSXSKHX-UHFFFAOYSA-N
Compound name
3-aminofluoren-9-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

87
Patents

195.06842 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.07570 138.6
[M+Na]+ 218.05764 149.4
[M-H]- 194.06114 144.6
[M+NH4]+ 213.10224 162.0
[M+K]+ 234.03158 144.5
[M+H-H2O]+ 178.06568 133.2
[M+HCOO]- 240.06662 163.2
[M+CH3COO]- 254.08227 153.2
[M+Na-2H]- 216.04309 145.7
[M]+ 195.06787 138.5
[M]- 195.06897 138.5
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

patents stripe