CID 24754

Phenolic resin

Structural Information

Molecular Formula

C₈H₆O₂

SMILES

[CH]C1=C(C(=CC=C1)O[CH])O

InChI

InChI=1S/C8H6O2/c1-6-4-3-5-7(10-2)8(6)9/h1-5,9H

InChIKey

KXGFMDJXCMQABM-UHFFFAOYSA-N

Compound name

None

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 172
References: 0
Patents: 134.03677 Da
Monoisotopic Mass: 2.1
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]+	135.044046	124.0
[M+Na]+	157.025988	133.4
[M-H]-	133.029494	127.3
[M+NH4]+	152.070593	145.8
[M+K]+	172.999928	132.0
[M+H-H2O]+	117.034030	119.3
[M+HCOO]-	179.034971	148.0
[M+CH3COO]-	193.050621	171.8
[M+Na-2H]-	155.011436	131.2
[M]+	134.03622142	125.4
[M]-	134.03731858	125.4

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.