CID 649084

356554-26-2

Structural Information

Molecular Formula

C₁₁H₁₁NO₂

SMILES

CC1=CC=C(O1)C(C2=CN=CC=C2)O

InChI

InChI=1S/C11H11NO2/c1-8-4-5-10(14-8)11(13)9-3-2-6-12-7-9/h2-7,11,13H,1H3

InChIKey

IAJIUQPRKJRSLJ-UHFFFAOYSA-N

Compound name

(5-methylfuran-2-yl)-pyridin-3-ylmethanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 8
References: 3
Patents: 189.07898 Da
Monoisotopic Mass: 1.2
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]+	190.08626	139.6
[M+Na]+	212.06820	152.9
[M+NH4]+	207.11280	148.0
[M+K]+	228.04214	149.1
[M-H]-	188.07170	143.7
[M+Na-2H]-	210.05365	147.2
[M]+	189.07843	142.7
[M]-	189.07953	142.7

Literature stripe

literature stripe

Patent stripe

patents stripe