CID 62312738

Oxolane-3-carboximidamide hydrochloride

Structural Information

Molecular Formula

C₅H₁₀N₂O

SMILES

C1COCC1C(=N)N

InChI

InChI=1S/C5H10N2O/c6-5(7)4-1-2-8-3-4/h4H,1-3H2,(H3,6,7)

InChIKey

VHYMNMJOIQJRTJ-UHFFFAOYSA-N

Compound name

oxolane-3-carboximidamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 26
Patents: 114.079315 Da
Monoisotopic Mass: -0.8
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]+	115.08659	123.1
[M+Na]+	137.06853	128.2
[M-H]-	113.07204	126.4
[M+NH4]+	132.11314	144.8
[M+K]+	153.04247	128.6
[M+H-H2O]+	97.076575	117.5
[M+HCOO]-	159.07752	146.5
[M+CH3COO]-	173.09317	171.0
[M+Na-2H]-	135.05398	128.3
[M]+	114.07877	117.3
[M]-	114.07986	117.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe