CID 27189

Napropamide

Structural Information

Molecular Formula

C₁₇H₂₁NO₂

SMILES

CCN(CC)C(=O)C(C)OC1=CC=CC2=CC=CC=C21

InChI

InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3

InChIKey

WXZVAROIGSFCFJ-UHFFFAOYSA-N

Compound name

N,N-diethyl-2-naphthalen-1-yloxypropanamide

Related CIDs

2D Structure

compound 2d structure

8
Annotation Hits: 38
References: 23769
Patents: 271.15723 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]+	272.16451	165.0
[M+Na]+	294.14645	170.2
[M-H]-	270.14995	170.2
[M+NH4]+	289.19105	182.5
[M+K]+	310.12039	168.5
[M+H-H2O]+	254.15449	157.4
[M+HCOO]-	316.15543	186.9
[M+CH3COO]-	330.17108	206.5
[M+Na-2H]-	292.13190	168.6
[M]+	271.15668	168.2
[M]-	271.15778	168.2

Literature stripe

literature stripe

Patent stripe

patents stripe