CID 3019249

83732-74-5

Structural Information

Molecular Formula

C₉H₁₈N₂O

SMILES

CC(=O)NCCC1CCCN1C

InChI

InChI=1S/C9H18N2O/c1-8(12)10-6-5-9-4-3-7-11(9)2/h9H,3-7H2,1-2H3,(H,10,12)

InChIKey

ICPOSULTPHUPHV-UHFFFAOYSA-N

Compound name

N-[2-(1-methylpyrrolidin-2-yl)ethyl]acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 54
Patents: 170.1419 Da
Monoisotopic Mass: 0.5
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]+	171.149176	140.8
[M+Na]+	193.131118	146.1
[M-H]-	169.134624	142.4
[M+NH4]+	188.175723	161.4
[M+K]+	209.105058	145.2
[M+H-H2O]+	153.139160	134.2
[M+HCOO]-	215.140101	162.3
[M+CH3COO]-	229.155751	182.0
[M+Na-2H]-	191.116566	143.0
[M]+	170.14135142	138.6
[M]-	170.14244858	138.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe