CID 13865597

114065-37-1

Structural Information

Molecular Formula

C₆H₁₁N₃O

SMILES

CC(C)(C)C1=NOC(=N1)N

InChI

InChI=1S/C6H11N3O/c1-6(2,3)4-8-5(7)10-9-4/h1-3H3,(H2,7,8,9)

InChIKey

ILUUSWWGUOPVLO-UHFFFAOYSA-N

Compound name

3-tert-butyl-1,2,4-oxadiazol-5-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 18
Patents: 141.09021 Da
Monoisotopic Mass: 1.7
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]+	142.09749	128.5
[M+Na]+	164.07943	138.9
[M+NH4]+	159.12403	135.6
[M+K]+	180.05337	137.3
[M-H]-	140.08293	129.6
[M+Na-2H]-	162.06488	133.1
[M]+	141.08966	130.1
[M]-	141.09076	130.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe