CID 66804

97-35-8

Structural Information

Molecular Formula

C₁₁H₁₈N₂O₃S

SMILES

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

InChI

InChI=1S/C11H18N2O3S/c1-4-13(5-2)17(14,15)9-6-7-11(16-3)10(12)8-9/h6-8H,4-5,12H2,1-3H3

InChIKey

WBGVVXSCGNGJFL-UHFFFAOYSA-N

Compound name

3-amino-N,N-diethyl-4-methoxybenzenesulfonamide

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 6
References: 339
Patents: 258.10382 Da
Monoisotopic Mass: 1.7
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]+	259.11110	158.0
[M+Na]+	281.09304	167.2
[M+NH4]+	276.13764	164.6
[M+K]+	297.06698	161.1
[M-H]-	257.09654	159.4
[M+Na-2H]-	279.07849	162.4
[M]+	258.10327	159.9
[M]-	258.10437	159.9

Literature stripe

literature stripe

Patent stripe

patents stripe