CID 69913

9-fluorenone-2-carboxylic acid

Structural Information

Molecular Formula
C14H8O3
SMILES
C1=CC=C2C(=C1)C3=C(C2=O)C=C(C=C3)C(=O)O
InChI
InChI=1S/C14H8O3/c15-13-11-4-2-1-3-9(11)10-6-5-8(14(16)17)7-12(10)13/h1-7H,(H,16,17)
InChIKey
BJCTXUUKONLPPK-UHFFFAOYSA-N
Compound name
9-oxofluorene-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

725
Patents

224.04735 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.05463 145.2
[M+Na]+ 247.03657 155.6
[M-H]- 223.04007 150.4
[M+NH4]+ 242.08117 167.0
[M+K]+ 263.01051 151.2
[M+H-H2O]+ 207.04461 140.1
[M+HCOO]- 269.04555 167.1
[M+CH3COO]- 283.06120 159.1
[M+Na-2H]- 245.02202 150.8
[M]+ 224.04680 146.9
[M]- 224.04790 146.9
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

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