CID 2760341

3-phenoxybenzoyl chloride

Structural Information

Molecular Formula
C13H9ClO2
SMILES
C1=CC=C(C=C1)OC2=CC=CC(=C2)C(=O)Cl
InChI
InChI=1S/C13H9ClO2/c14-13(15)10-5-4-8-12(9-10)16-11-6-2-1-3-7-11/h1-9H
InChIKey
TTZXIWBOKOZOPL-UHFFFAOYSA-N
Compound name
3-phenoxybenzoyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

241
Patents

232.02911 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 233.03639 147.4
[M+Na]+ 255.01833 163.6
[M+NH4]+ 250.06293 157.1
[M+K]+ 270.99227 155.2
[M-H]- 231.02183 152.3
[M+Na-2H]- 253.00378 158.0
[M]+ 232.02856 151.6
[M]- 232.02966 151.6
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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