CID 42614330

619329-27-0

Structural Information

Molecular Formula

C₅H₁₀N₂O

SMILES

C1CC(OC1)C(=N)N

InChI

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

InChIKey

OUAFMLDGDMRISR-UHFFFAOYSA-N

Compound name

oxolane-2-carboximidamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 48
Patents: 114.079315 Da
Monoisotopic Mass: -0.4
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]+	115.086591	123.1
[M+Na]+	137.068533	128.2
[M-H]-	113.072039	126.4
[M+NH4]+	132.113138	144.8
[M+K]+	153.042473	128.6
[M+H-H2O]+	97.076575	117.5
[M+HCOO]-	159.077516	146.5
[M+CH3COO]-	173.093166	171.0
[M+Na-2H]-	135.053981	128.3
[M]+	114.07876642	117.3
[M]-	114.07986358	117.3

Literature stripe

literature stripe

Patent stripe

patents stripe