CID 210615

Indene-3-ethylamine, n,n,2-trimethyl-, hydrochloride

Structural Information

Molecular Formula

C₁₄H₁₉N

SMILES

CC1=C(C2=CC=CC=C2C1)CCN(C)C

InChI

InChI=1S/C14H19N/c1-11-10-12-6-4-5-7-14(12)13(11)8-9-15(2)3/h4-7H,8-10H2,1-3H3

InChIKey

IFCSJEYRXXMVRP-UHFFFAOYSA-N

Compound name

N,N-dimethyl-2-(2-methyl-3H-inden-1-yl)ethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 201.15175 Da
Monoisotopic Mass: 2.5
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]+	202.159026	147.1
[M+Na]+	224.140968	154.9
[M-H]-	200.144474	153.1
[M+NH4]+	219.185573	170.1
[M+K]+	240.114908	152.4
[M+H-H2O]+	184.149010	141.0
[M+HCOO]-	246.149951	172.2
[M+CH3COO]-	260.165601	194.4
[M+Na-2H]-	222.126416	151.5
[M]+	201.15120142	149.6
[M]-	201.15229858	149.6

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.