CID 210015

20845-57-2

Structural Information

Molecular Formula

C₁₅H₂₁NO

SMILES

CN1CCC(CC1)C2CC3=CC=CC=C3C2O

InChI

InChI=1S/C15H21NO/c1-16-8-6-11(7-9-16)14-10-12-4-2-3-5-13(12)15(14)17/h2-5,11,14-15,17H,6-10H2,1H3

InChIKey

FLNPMFIPMFSRQX-UHFFFAOYSA-N

Compound name

2-(1-methylpiperidin-4-yl)-2,3-dihydro-1H-inden-1-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 231.16231 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]+	232.16959	155.0
[M+Na]+	254.15153	160.8
[M-H]-	230.15503	159.2
[M+NH4]+	249.19613	173.8
[M+K]+	270.12547	156.3
[M+H-H2O]+	214.15957	147.8
[M+HCOO]-	276.16051	171.3
[M+CH3COO]-	290.17616	166.0
[M+Na-2H]-	252.13698	156.2
[M]+	231.16176	149.4
[M]-	231.16286	149.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe