CID 295571

N-(dimethylaminomethyl)-phthalimide

Structural Information

Molecular Formula

C₁₁H₁₂N₂O₂

SMILES

CN(C)CN1C(=O)C2=CC=CC=C2C1=O

InChI

InChI=1S/C11H12N2O2/c1-12(2)7-13-10(14)8-5-3-4-6-9(8)11(13)15/h3-6H,7H2,1-2H3

InChIKey

RZDNXBOXSFUJAK-UHFFFAOYSA-N

Compound name

2-[(dimethylamino)methyl]isoindole-1,3-dione

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 1326
Patents: 204.08987 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]+	205.097146	142.2
[M+Na]+	227.079088	151.6
[M-H]-	203.082594	147.4
[M+NH4]+	222.123693	163.6
[M+K]+	243.053028	149.8
[M+H-H2O]+	187.087130	135.8
[M+HCOO]-	249.088071	166.4
[M+CH3COO]-	263.103721	191.8
[M+Na-2H]-	225.064536	146.7
[M]+	204.08932142	144.6
[M]-	204.09041858	144.6

Literature stripe

literature stripe

Patent stripe

patents stripe