CID 3034961

104295-55-8

Structural Information

Molecular Formula

C₁₁H₁₂N₂O₂S

SMILES

CNS(=O)(=O)C1=CC2=C(C=C1)C=C(C=C2)N

InChI

InChI=1S/C11H12N2O2S/c1-13-16(14,15)11-5-3-8-6-10(12)4-2-9(8)7-11/h2-7,13H,12H2,1H3

InChIKey

RBQODZRXIYFUJS-UHFFFAOYSA-N

Compound name

6-amino-N-methylnaphthalene-2-sulfonamide

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 43
Patents: 236.06195 Da
Monoisotopic Mass: 1.5
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]+	237.06923	147.5
[M+Na]+	259.05117	156.4
[M-H]-	235.05467	152.0
[M+NH4]+	254.09577	166.2
[M+K]+	275.02511	152.1
[M+H-H2O]+	219.05921	141.5
[M+HCOO]-	281.06015	166.6
[M+CH3COO]-	295.07580	193.0
[M+Na-2H]-	257.03662	154.5
[M]+	236.06140	148.5
[M]-	236.06250	148.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe