CID 7095

Biphenyl

Structural Information

Molecular Formula

C₁₂H₁₀

SMILES

C1=CC=C(C=C1)C2=CC=CC=C2

InChI

InChI=1S/C12H10/c1-3-7-11(8-4-1)12-9-5-2-6-10-12/h1-10H

InChIKey

ZUOUZKKEUPVFJK-UHFFFAOYSA-N

Compound name

1,1'-biphenyl

Related CIDs

2D Structure

compound 2d structure

9
Annotation Hits: 7917
References: 104395
Patents: 154.07825 Da
Monoisotopic Mass: 4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	155.08553	131.7
[M+Na]+	177.06747	148.3
[M+NH4]+	172.11207	142.9
[M+K]+	193.04141	138.9
[M-H]-	153.07097	138.1
[M+Na-2H]-	175.05292	144.2
[M]+	154.07770	136.2
[M]-	154.07880	136.2

Literature stripe

literature stripe

Patent stripe

patents stripe