CID 25219494

1185294-83-0

Structural Information

Molecular Formula

C₆H₁₁N₃O₂

SMILES

COCCC1=NOC(=N1)CN

InChI

InChI=1S/C6H11N3O2/c1-10-3-2-5-8-6(4-7)11-9-5/h2-4,7H2,1H3

InChIKey

VBTBHNJQCHTJIQ-UHFFFAOYSA-N

Compound name

[3-(2-methoxyethyl)-1,2,4-oxadiazol-5-yl]methanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 157.08513 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]+	158.09241	131.6
[M+Na]+	180.07435	141.9
[M+NH4]+	175.11895	138.3
[M+K]+	196.04829	139.5
[M-H]-	156.07785	132.8
[M+Na-2H]-	178.05980	135.8
[M]+	157.08458	133.0
[M]-	157.08568	133.0

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.