CID 10442498

37663-44-8

Structural Information

Molecular Formula

C₁₂H₁₅NO

SMILES

C1CNCCC12C3=CC=CC=C3CO2

InChI

InChI=1S/C12H15NO/c1-2-4-11-10(3-1)9-14-12(11)5-7-13-8-6-12/h1-4,13H,5-9H2

InChIKey

BYOIMOJOKVUNTP-UHFFFAOYSA-N

Compound name

spiro[1H-2-benzofuran-3,4'-piperidine]

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 882
Patents: 189.11537 Da
Monoisotopic Mass: 1.1
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]+	190.12265	142.8
[M+Na]+	212.10459	154.8
[M+NH4]+	207.14919	154.3
[M+K]+	228.07853	147.6
[M-H]-	188.10809	147.4
[M+Na-2H]-	210.09004	149.6
[M]+	189.11482	146.0
[M]-	189.11592	146.0

Literature stripe

literature stripe

Patent stripe

patents stripe