CID 601613

22868-60-6

Structural Information

Molecular Formula

C₁₀H₁₃NO₂

SMILES

C1CCN(CC1)C2=CC=C(O2)C=O

InChI

InChI=1S/C10H13NO2/c12-8-9-4-5-10(13-9)11-6-2-1-3-7-11/h4-5,8H,1-3,6-7H2

InChIKey

UEIBBOBGTJMFRM-UHFFFAOYSA-N

Compound name

5-piperidin-1-ylfuran-2-carbaldehyde

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 60
Patents: 179.09464 Da
Monoisotopic Mass: 2.1
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]+	180.10192	138.9
[M+Na]+	202.08386	150.5
[M+NH4]+	197.12846	147.4
[M+K]+	218.05780	146.3
[M-H]-	178.08736	142.9
[M+Na-2H]-	200.06931	144.8
[M]+	179.09409	141.5
[M]-	179.09519	141.5

Literature stripe

literature stripe

Patent stripe

patents stripe