CID 69870

Tetrafluorohydroquinone

Structural Information

Molecular Formula

C₆H₂F₄O₂

SMILES

C1(=C(C(=C(C(=C1F)F)O)F)F)O

InChI

InChI=1S/C6H2F4O2/c7-1-2(8)6(12)4(10)3(9)5(1)11/h11-12H

InChIKey

ZSDAMBJDFDRLSS-UHFFFAOYSA-N

Compound name

2,3,5,6-tetrafluorobenzene-1,4-diol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 3804
Patents: 181.99908 Da
Monoisotopic Mass: 2.8
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]+	183.00636	125.5
[M+Na]+	204.98830	138.1
[M-H]-	180.99180	123.1
[M+NH4]+	200.03290	145.1
[M+K]+	220.96224	134.5
[M+H-H2O]+	164.99634	118.0
[M+HCOO]-	226.99728	144.1
[M+CH3COO]-	241.01293	178.2
[M+Na-2H]-	202.97375	128.5
[M]+	181.99853	120.6
[M]-	181.99963	120.6

Literature stripe

literature stripe

Patent stripe

patents stripe