CID 53154

4-chlorodibenzofuran

Structural Information

Molecular Formula
C12H7ClO
SMILES
C1=CC=C2C(=C1)C3=C(O2)C(=CC=C3)Cl
InChI
InChI=1S/C12H7ClO/c13-10-6-3-5-9-8-4-1-2-7-11(8)14-12(9)10/h1-7H
InChIKey
RHRYBWFAHXCUCR-UHFFFAOYSA-N
Compound name
4-chlorodibenzofuran
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

5
References

59
Patents

202.01854 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 203.02582 136.1
[M+Na]+ 225.00776 154.1
[M+NH4]+ 220.05236 148.0
[M+K]+ 240.98170 146.6
[M-H]- 201.01126 142.2
[M+Na-2H]- 222.99321 144.9
[M]+ 202.01799 141.1
[M]- 202.01909 141.1
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