CID 245487

2-acetamido-1,3,4,7-tetrachlorofluorene

Structural Information

Molecular Formula
C15H9Cl4NO
SMILES
CC(=O)NC1=C(C2=C(C3=C(C2)C=C(C=C3)Cl)C(=C1Cl)Cl)Cl
InChI
InChI=1S/C15H9Cl4NO/c1-6(21)20-15-12(17)10-5-7-4-8(16)2-3-9(7)11(10)13(18)14(15)19/h2-4H,5H2,1H3,(H,20,21)
InChIKey
WQRUPKUYVMSSBU-UHFFFAOYSA-N
Compound name
N-(1,3,4,7-tetrachloro-9H-fluoren-2-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

0
Patents

358.94382 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 359.95110 179.0
[M+Na]+ 381.93304 191.4
[M-H]- 357.93654 181.6
[M+NH4]+ 376.97764 197.1
[M+K]+ 397.90698 183.6
[M+H-H2O]+ 341.94108 176.0
[M+HCOO]- 403.94202 181.4
[M+CH3COO]- 417.95767 189.2
[M+Na-2H]- 379.91849 178.4
[M]+ 358.94327 183.7
[M]- 358.94437 183.7
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

No patent data available for this compound.