CID 14913728

Methyl[2-(naphthalen-1-yl)ethyl]amine

Structural Information

Molecular Formula

C₁₃H₁₅N

SMILES

CNCCC1=CC=CC2=CC=CC=C21

InChI

InChI=1S/C13H15N/c1-14-10-9-12-7-4-6-11-5-2-3-8-13(11)12/h2-8,14H,9-10H2,1H3

InChIKey

YGXDJFKCOBYLFG-UHFFFAOYSA-N

Compound name

N-methyl-2-naphthalen-1-ylethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 56
Patents: 185.12045 Da
Monoisotopic Mass: 3.4
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]+	186.12773	139.4
[M+Na]+	208.10967	146.7
[M-H]-	184.11317	143.8
[M+NH4]+	203.15427	160.2
[M+K]+	224.08361	142.9
[M+H-H2O]+	168.11771	133.0
[M+HCOO]-	230.11865	163.7
[M+CH3COO]-	244.13430	186.8
[M+Na-2H]-	206.09512	148.5
[M]+	185.11990	139.2
[M]-	185.12100	139.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe