CID 50988080

1251925-12-8

Structural Information

Molecular Formula

C₁₀H₁₇N₃O

SMILES

CC(C)C1=NC(=NO1)C2CCCNC2

InChI

InChI=1S/C10H17N3O/c1-7(2)10-12-9(13-14-10)8-4-3-5-11-6-8/h7-8,11H,3-6H2,1-2H3

InChIKey

QHRQWYQHLSLMOO-UHFFFAOYSA-N

Compound name

3-piperidin-3-yl-5-propan-2-yl-1,2,4-oxadiazole

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 0
Patents: 195.13716 Da
Monoisotopic Mass: 1.4
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]+	196.14444	145.6
[M+Na]+	218.12638	156.2
[M+NH4]+	213.17098	152.7
[M+K]+	234.10032	153.3
[M-H]-	194.12988	147.8
[M+Na-2H]-	216.11183	150.1
[M]+	195.13661	147.4
[M]-	195.13771	147.4

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.