CID 16883

4-vinylbiphenyl

Structural Information

Molecular Formula

C₁₄H₁₂

SMILES

C=CC1=CC=C(C=C1)C2=CC=CC=C2

InChI

InChI=1S/C14H12/c1-2-12-8-10-14(11-9-12)13-6-4-3-5-7-13/h2-11H,1H2

InChIKey

HDBWAWNLGGMZRQ-UHFFFAOYSA-N

Compound name

1-ethenyl-4-phenylbenzene

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 4
References: 16652
Patents: 180.0939 Da
Monoisotopic Mass: 5.0
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]+	181.10118	139.6
[M+Na]+	203.08312	156.2
[M+NH4]+	198.12772	150.2
[M+K]+	219.05706	146.5
[M-H]-	179.08662	145.7
[M+Na-2H]-	201.06857	151.3
[M]+	180.09335	144.0
[M]-	180.09445	144.0

Literature stripe

literature stripe

Patent stripe

patents stripe