CID 521293

Fulminic acid

Structural Information

Molecular Formula

SMILES

C#[N+][O-]

InChI

InChI=1S/CHNO/c1-2-3/h1H

InChIKey

UXKUODQYLDZXDL-UHFFFAOYSA-N

Compound name

formonitrile oxide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 1998
Patents: 43.005814 Da
Monoisotopic Mass: -0.5
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]+	44.013090	103.9
[M+Na]+	65.995032	114.7
[M-H]-	41.998538	104.4
[M+NH4]+	61.039637	126.2
[M+K]+	81.968972	111.1
[M+H-H2O]+	26.003074	98.7
[M+HCOO]-	88.004015	125.3
[M+CH3COO]-	102.01966	162.2
[M+Na-2H]-	63.980480	114.1
[M]+	43.005265	97.0
[M]-	43.006363	97.0

Literature stripe

literature stripe

Patent stripe

patents stripe