CID 86811819

2-amino-3-(dimethylamino)-n,n-dimethylbenzene-1-sulfonamide

Structural Information

Molecular Formula

C₁₀H₁₇N₃O₂S

SMILES

CN(C)C1=C(C(=CC=C1)S(=O)(=O)N(C)C)N

InChI

InChI=1S/C10H17N3O2S/c1-12(2)8-6-5-7-9(10(8)11)16(14,15)13(3)4/h5-7H,11H2,1-4H3

InChIKey

FFRRRUARUTWDEW-UHFFFAOYSA-N

Compound name

2-amino-3-(dimethylamino)-N,N-dimethylbenzenesulfonamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 243.10414 Da
Monoisotopic Mass: 1.1
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]+	244.111416	152.6
[M+Na]+	266.093358	159.7
[M-H]-	242.096864	158.9
[M+NH4]+	261.137963	170.9
[M+K]+	282.067298	158.8
[M+H-H2O]+	226.101400	145.5
[M+HCOO]-	288.102341	173.7
[M+CH3COO]-	302.117991	204.3
[M+Na-2H]-	264.078806	155.3
[M]+	243.10359142	155.7
[M]-	243.10468858	155.7

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.