CID 4210488

Acetic acid, 2-(2-furanylmethylene)hydrazide

Structural Information

Molecular Formula

C₇H₈N₂O₂

SMILES

CC(=O)NN=CC1=CC=CO1

InChI

InChI=1S/C7H8N2O2/c1-6(10)9-8-5-7-3-2-4-11-7/h2-5H,1H3,(H,9,10)

InChIKey

ZIIRIMZLPJIXLO-UHFFFAOYSA-N

Compound name

N-(furan-2-ylmethylideneamino)acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 152.05858 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]+	153.06586	130.1
[M+Na]+	175.04780	137.3
[M-H]-	151.05130	135.9
[M+NH4]+	170.09240	151.6
[M+K]+	191.02174	138.0
[M+H-H2O]+	135.05584	123.9
[M+HCOO]-	197.05678	158.4
[M+CH3COO]-	211.07243	179.4
[M+Na-2H]-	173.03325	137.8
[M]+	152.05803	131.5
[M]-	152.05913	131.5

Literature stripe

literature stripe

Patent stripe

patents stripe