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

154
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

literature stripe

Patent stripe

patents stripe