CID 60871254

2-(pyrazin-2-yloxy)phenol

Structural Information

Molecular Formula

C₁₀H₈N₂O₂

SMILES

C1=CC=C(C(=C1)O)OC2=NC=CN=C2

InChI

InChI=1S/C10H8N2O2/c13-8-3-1-2-4-9(8)14-10-7-11-5-6-12-10/h1-7,13H

InChIKey

NPYVLUYPXFAYPV-UHFFFAOYSA-N

Compound name

2-pyrazin-2-yloxyphenol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 188.05858 Da
Monoisotopic Mass: 1.3
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]+	189.065856	137.4
[M+Na]+	211.047798	146.3
[M-H]-	187.051304	140.5
[M+NH4]+	206.092403	153.5
[M+K]+	227.021738	143.0
[M+H-H2O]+	171.055840	129.1
[M+HCOO]-	233.056781	159.4
[M+CH3COO]-	247.072431	150.4
[M+Na-2H]-	209.033246	146.7
[M]+	188.05803142	137.4
[M]-	188.05912858	137.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe