CID 23119

2-hydroxy-7-nitrofluorene

Structural Information

Molecular Formula
C13H9NO3
SMILES
C1C2=C(C=CC(=C2)[N+](=O)[O-])C3=C1C=C(C=C3)O
InChI
InChI=1S/C13H9NO3/c15-11-2-4-13-9(7-11)5-8-6-10(14(16)17)1-3-12(8)13/h1-4,6-7,15H,5H2
InChIKey
VFTOHJFKIJLYKN-UHFFFAOYSA-N
Compound name
7-nitro-9H-fluoren-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

9
References

1498
Patents

227.05824 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 228.06552 145.3
[M+Na]+ 250.04746 154.0
[M-H]- 226.05096 150.2
[M+NH4]+ 245.09206 165.9
[M+K]+ 266.02140 145.9
[M+H-H2O]+ 210.05550 144.4
[M+HCOO]- 272.05644 168.6
[M+CH3COO]- 286.07209 182.7
[M+Na-2H]- 248.03291 153.9
[M]+ 227.05769 144.5
[M]- 227.05879 144.5
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