CID 573527

1-(dimethylamino)pyrrole

Structural Information

Molecular Formula

C₆H₁₀N₂

SMILES

CN(C)N1C=CC=C1

InChI

InChI=1S/C6H10N2/c1-7(2)8-5-3-4-6-8/h3-6H,1-2H3

InChIKey

ZOORJGVSPXCZCJ-UHFFFAOYSA-N

Compound name

N,N-dimethylpyrrol-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 203
Patents: 110.0844 Da
Monoisotopic Mass: 1.2
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]+	111.09168	120.5
[M+Na]+	133.07362	128.4
[M-H]-	109.07712	124.4
[M+NH4]+	128.11822	144.2
[M+K]+	149.04756	128.9
[M+H-H2O]+	93.081660	114.1
[M+HCOO]-	155.08260	147.0
[M+CH3COO]-	169.09825	173.4
[M+Na-2H]-	131.05907	127.6
[M]+	110.08385	121.0
[M]-	110.08495	121.0

Literature stripe

literature stripe

Patent stripe

patents stripe