CID 88610

Formamide, n,n'-ethylidenebis-

Structural Information

Molecular Formula

C₄H₈N₂O₂

SMILES

CC(NC=O)NC=O

InChI

InChI=1S/C4H8N2O2/c1-4(5-2-7)6-3-8/h2-4H,1H3,(H,5,7)(H,6,8)

InChIKey

OYFXZONQZDQAMM-UHFFFAOYSA-N

Compound name

N-(1-formamidoethyl)formamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 107
Patents: 116.05858 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]+	117.06586	121.1
[M+Na]+	139.04780	127.6
[M-H]-	115.05130	121.6
[M+NH4]+	134.09240	142.8
[M+K]+	155.02174	128.0
[M+H-H2O]+	99.055840	115.9
[M+HCOO]-	161.05678	147.4
[M+CH3COO]-	175.07243	173.7
[M+Na-2H]-	137.03325	128.3
[M]+	116.05803	120.7
[M]-	116.05913	120.7

Literature stripe

literature stripe

Patent stripe

patents stripe