CID 71212150

1447606-13-4

Structural Information

Molecular Formula

C₁₄H₁₇NO₂

SMILES

COC1=CC2=C(C=C1)C(=O)C3(C2)CCNCC3

InChI

InChI=1S/C14H17NO2/c1-17-11-2-3-12-10(8-11)9-14(13(12)16)4-6-15-7-5-14/h2-3,8,15H,4-7,9H2,1H3

InChIKey

LQAWCNXOMNNZQK-UHFFFAOYSA-N

Compound name

5-methoxyspiro[3H-indene-2,4'-piperidine]-1-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 13
Patents: 231.12593 Da
Monoisotopic Mass: 1.6
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]+	232.13321	153.8
[M+Na]+	254.11515	165.2
[M+NH4]+	249.15975	164.2
[M+K]+	270.08909	158.1
[M-H]-	230.11865	156.3
[M+Na-2H]-	252.10060	159.6
[M]+	231.12538	156.1
[M]-	231.12648	156.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe