CID 118922

N-propyl-2-naphthalenamine

Structural Information

Molecular Formula

C₁₃H₁₅N

SMILES

CCCNC1=CC2=CC=CC=C2C=C1

InChI

InChI=1S/C13H15N/c1-2-9-14-13-8-7-11-5-3-4-6-12(11)10-13/h3-8,10,14H,2,9H2,1H3

InChIKey

KEFWNHAJKUZOOG-UHFFFAOYSA-N

Compound name

N-propylnaphthalen-2-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 39
Patents: 185.12045 Da
Monoisotopic Mass: 4.4
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]+	186.127726	139.4
[M+Na]+	208.109668	146.7
[M-H]-	184.113174	143.8
[M+NH4]+	203.154273	160.2
[M+K]+	224.083608	142.9
[M+H-H2O]+	168.117710	133.0
[M+HCOO]-	230.118651	163.7
[M+CH3COO]-	244.134301	186.8
[M+Na-2H]-	206.095116	148.5
[M]+	185.11990142	139.2
[M]-	185.12099858	139.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe