CID 3070203

5-benzofuranol, 2,4,6,7-tetramethyl-

Structural Information

Molecular Formula

C₁₂H₁₄O₂

SMILES

CC1=CC2=C(O1)C(=C(C(=C2C)O)C)C

InChI

InChI=1S/C12H14O2/c1-6-5-10-9(4)11(13)7(2)8(3)12(10)14-6/h5,13H,1-4H3

InChIKey

LUBMXGPYYNNQKI-UHFFFAOYSA-N

Compound name

2,4,6,7-tetramethyl-1-benzofuran-5-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 5
Patents: 190.09938 Da
Monoisotopic Mass: 3.5
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]+	191.10666	138.0
[M+Na]+	213.08860	153.2
[M+NH4]+	208.13320	147.4
[M+K]+	229.06254	148.6
[M-H]-	189.09210	142.0
[M+Na-2H]-	211.07405	143.6
[M]+	190.09883	141.5
[M]-	190.09993	141.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe