CID 12563768

[1,1'-biphenyl]-2-carbonyl chloride

Structural Information

Molecular Formula
C13H9ClO
SMILES
C1=CC=C(C=C1)C2=CC=CC=C2C(=O)Cl
InChI
InChI=1S/C13H9ClO/c14-13(15)12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9H
InChIKey
MPJOJCZVGBOVOV-UHFFFAOYSA-N
Compound name
2-phenylbenzoyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

723
Patents

216.0342 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 217.04148 144.4
[M+Na]+ 239.02342 161.2
[M+NH4]+ 234.06802 154.7
[M+K]+ 254.99736 152.1
[M-H]- 215.02692 149.8
[M+Na-2H]- 237.00887 155.5
[M]+ 216.03365 148.9
[M]- 216.03475 148.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

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Patent stripe

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