CID 610142

9-fluorenone-4-carbonyl chloride

Structural Information

Molecular Formula
C14H7ClO2
SMILES
C1=CC=C2C(=C1)C3=C(C2=O)C=CC=C3C(=O)Cl
InChI
InChI=1S/C14H7ClO2/c15-14(17)11-7-3-6-10-12(11)8-4-1-2-5-9(8)13(10)16/h1-7H
InChIKey
XKCGWCQMEUASJF-UHFFFAOYSA-N
Compound name
9-oxofluorene-4-carbonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

152
Patents

242.01346 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 243.02074 149.7
[M+Na]+ 265.00268 161.6
[M-H]- 241.00618 156.0
[M+NH4]+ 260.04728 172.3
[M+K]+ 280.97662 155.5
[M+H-H2O]+ 225.01072 145.0
[M+HCOO]- 287.01166 168.3
[M+CH3COO]- 301.02731 163.9
[M+Na-2H]- 262.98813 155.0
[M]+ 242.01291 153.9
[M]- 242.01401 153.9
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.