CID 3381931

35693-45-9

Structural Information

Molecular Formula

C₁₅H₁₉N

SMILES

CCN(CC)CC1=CC=CC2=CC=CC=C21

InChI

InChI=1S/C15H19N/c1-3-16(4-2)12-14-10-7-9-13-8-5-6-11-15(13)14/h5-11H,3-4,12H2,1-2H3

InChIKey

JIDHYTMOPLMDLX-UHFFFAOYSA-N

Compound name

N-ethyl-N-(naphthalen-1-ylmethyl)ethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 11
Patents: 213.15175 Da
Monoisotopic Mass: 3.8
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]+	214.159026	149.3
[M+Na]+	236.140968	155.8
[M-H]-	212.144474	154.8
[M+NH4]+	231.185573	169.6
[M+K]+	252.114908	153.0
[M+H-H2O]+	196.149010	142.3
[M+HCOO]-	258.149951	173.3
[M+CH3COO]-	272.165601	196.3
[M+Na-2H]-	234.126416	156.5
[M]+	213.15120142	151.0
[M]-	213.15229858	151.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe