CID 16740522

2-(3-methoxyphenyl)pyrazine

Structural Information

Molecular Formula

C₁₁H₁₀N₂O

SMILES

COC1=CC=CC(=C1)C2=NC=CN=C2

InChI

InChI=1S/C11H10N2O/c1-14-10-4-2-3-9(7-10)11-8-12-5-6-13-11/h2-8H,1H3

InChIKey

FFKZZCMVJFZYQQ-UHFFFAOYSA-N

Compound name

2-(3-methoxyphenyl)pyrazine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 18
Patents: 186.07932 Da
Monoisotopic Mass: 1.4
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]+	187.08660	139.1
[M+Na]+	209.06854	155.2
[M+NH4]+	204.11314	148.0
[M+K]+	225.04248	147.3
[M-H]-	185.07204	143.1
[M+Na-2H]-	207.05399	150.1
[M]+	186.07877	142.7
[M]-	186.07987	142.7

Literature stripe

literature stripe

Patent stripe

patents stripe