CID 80055529

2580188-76-5

Structural Information

Molecular Formula

C₅H₉N₃O₂

SMILES

COC1=NC(=NO1)CCN

InChI

InChI=1S/C5H9N3O2/c1-9-5-7-4(2-3-6)8-10-5/h2-3,6H2,1H3

InChIKey

CMOCJNGROXEPNM-UHFFFAOYSA-N

Compound name

2-(5-methoxy-1,2,4-oxadiazol-3-yl)ethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 143.06947 Da
Monoisotopic Mass: -0.2
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]+	144.07675	127.1
[M+Na]+	166.05869	137.6
[M+NH4]+	161.10329	134.0
[M+K]+	182.03263	135.5
[M-H]-	142.06219	128.3
[M+Na-2H]-	164.04414	131.6
[M]+	143.06892	128.6
[M]-	143.07002	128.6

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.