CID 25248074

1018163-32-0

Structural Information

Molecular Formula

C₁₀H₁₆N₂O

SMILES

CCCC1=CC(=NO1)C2CCCN2

InChI

InChI=1S/C10H16N2O/c1-2-4-8-7-10(12-13-8)9-5-3-6-11-9/h7,9,11H,2-6H2,1H3

InChIKey

IAUIEWRFLJGUJS-UHFFFAOYSA-N

Compound name

5-propyl-3-pyrrolidin-2-yl-1,2-oxazole

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 180.12627 Da
Monoisotopic Mass: 1.5
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]+	181.13355	141.0
[M+Na]+	203.11549	151.2
[M+NH4]+	198.16009	148.9
[M+K]+	219.08943	149.3
[M-H]-	179.11899	143.6
[M+Na-2H]-	201.10094	145.5
[M]+	180.12572	142.9
[M]-	180.12682	142.9

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.