CID 6486603

3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidine hydrochloride

Structural Information

Molecular Formula

C₈H₁₃N₃O

SMILES

CC1=NOC(=N1)C2CCCNC2

InChI

InChI=1S/C8H13N3O/c1-6-10-8(12-11-6)7-3-2-4-9-5-7/h7,9H,2-5H2,1H3

InChIKey

MPYNENJKQSNBDF-UHFFFAOYSA-N

Compound name

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

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 78
Patents: 167.10587 Da
Monoisotopic Mass: 0.7
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]+	168.11315	136.8
[M+Na]+	190.09509	148.2
[M+NH4]+	185.13969	144.4
[M+K]+	206.06903	144.9
[M-H]-	166.09859	139.3
[M+Na-2H]-	188.08054	142.2
[M]+	167.10532	138.9
[M]-	167.10642	138.9

Literature stripe

literature stripe

Patent stripe

patents stripe