CID 210112

20984-64-9

Structural Information

Molecular Formula

C₁₃H₁₉N₃O

SMILES

CNC(=O)N1CCC(C1)N(C)C2=CC=CC=C2

InChI

InChI=1S/C13H19N3O/c1-14-13(17)16-9-8-12(10-16)15(2)11-6-4-3-5-7-11/h3-7,12H,8-10H2,1-2H3,(H,14,17)

InChIKey

GYBLKFWKFLAZSR-UHFFFAOYSA-N

Compound name

N-methyl-3-(N-methylanilino)pyrrolidine-1-carboxamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 233.15282 Da
Monoisotopic Mass: 1.6
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]+	234.160096	154.6
[M+Na]+	256.142038	158.9
[M-H]-	232.145544	160.9
[M+NH4]+	251.186643	172.6
[M+K]+	272.115978	157.5
[M+H-H2O]+	216.150080	146.2
[M+HCOO]-	278.151021	178.0
[M+CH3COO]-	292.166671	197.3
[M+Na-2H]-	254.127486	157.0
[M]+	233.15227142	151.9
[M]-	233.15336858	151.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe