CID 3779308

571150-08-8

Structural Information

Molecular Formula

C₁₀H₁₅ClN₂O₂S

SMILES

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)N)Cl

InChI

InChI=1S/C10H15ClN2O2S/c1-3-13(4-2)16(14,15)10-7-8(12)5-6-9(10)11/h5-7H,3-4,12H2,1-2H3

InChIKey

JJYDDVHNVRFVNS-UHFFFAOYSA-N

Compound name

5-amino-2-chloro-N,N-diethylbenzenesulfonamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 9
Patents: 262.0543 Da
Monoisotopic Mass: 1.8
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]+	263.06158	157.5
[M+Na]+	285.04352	168.1
[M+NH4]+	280.08812	165.1
[M+K]+	301.01746	160.9
[M-H]-	261.04702	159.5
[M+Na-2H]-	283.02897	162.6
[M]+	262.05375	160.2
[M]-	262.05485	160.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe