CID 5166334

5-methylfuran-2-carboxamide

Structural Information

Molecular Formula

SMILES

CC1=CC=C(O1)C(=O)N

InChI

InChI=1S/C6H7NO2/c1-4-2-3-5(9-4)6(7)8/h2-3H,1H3,(H2,7,8)

InChIKey

HTLIXYXARPLOIU-UHFFFAOYSA-N

Compound name

5-methylfuran-2-carboxamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 195
Patents: 125.047676 Da
Monoisotopic Mass: 0.6
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]+	126.05495	123.0
[M+Na]+	148.03689	133.5
[M+NH4]+	143.08150	131.1
[M+K]+	164.01083	131.3
[M-H]-	124.04040	125.5
[M+Na-2H]-	146.02234	127.7
[M]+	125.04713	124.9
[M]-	125.04822	124.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe