CID 13287086

Brn 5529277

Structural Information

Molecular Formula

C₁₀H₁₇N₃O₂

SMILES

CC(=NC(=O)CN1CCCC1=O)N(C)C

InChI

InChI=1S/C10H17N3O2/c1-8(12(2)3)11-9(14)7-13-6-4-5-10(13)15/h4-7H2,1-3H3

InChIKey

SAIIUEANDOBPEJ-UHFFFAOYSA-N

Compound name

N-[1-(dimethylamino)ethylidene]-2-(2-oxopyrrolidin-1-yl)acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 211.13208 Da
Monoisotopic Mass: -0.6
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]+	212.139356	149.4
[M+Na]+	234.121298	154.4
[M-H]-	210.124804	154.0
[M+NH4]+	229.165903	169.2
[M+K]+	250.095238	155.2
[M+H-H2O]+	194.129340	142.0
[M+HCOO]-	256.130281	173.2
[M+CH3COO]-	270.145931	195.9
[M+Na-2H]-	232.106746	150.2
[M]+	211.13153142	149.2
[M]-	211.13262858	149.2

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.