CID 6894999

72606-47-4

Structural Information

Molecular Formula

C₁₇H₁₉N₃O₂

SMILES

C1COCCN1CC(=O)N/N=C/C2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C17H19N3O2/c21-17(13-20-8-10-22-11-9-20)19-18-12-15-6-3-5-14-4-1-2-7-16(14)15/h1-7,12H,8-11,13H2,(H,19,21)/b18-12+

InChIKey

RAMCIAMKCIOPKA-LDADJPATSA-N

Compound name

2-morpholin-4-yl-N-[(E)-naphthalen-1-ylmethylideneamino]acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 6
References: 1
Patents: 297.14774 Da
Monoisotopic Mass: 2.1
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]+	298.155016	168.3
[M+Na]+	320.136958	171.8
[M-H]-	296.140464	174.9
[M+NH4]+	315.181563	181.0
[M+K]+	336.110898	169.1
[M+H-H2O]+	280.145000	158.2
[M+HCOO]-	342.145941	188.2
[M+CH3COO]-	356.161591	208.1
[M+Na-2H]-	318.122406	175.1
[M]+	297.14719142	165.3
[M]-	297.14828858	165.3

Literature stripe

literature stripe

Patent stripe

patents stripe