CID 214660

Sulfamoyl azide, (p-methoxyphenyl)-

Structural Information

Molecular Formula

C₇H₈N₄O₃S

SMILES

COC1=CC=C(C=C1)NS(=O)(=O)N=[N+]=[N-]

InChI

InChI=1S/C7H8N4O3S/c1-14-7-4-2-6(3-5-7)9-15(12,13)11-10-8/h2-5,9H,1H3

InChIKey

WWYHZOMJZFBCHC-UHFFFAOYSA-N

Compound name

1-(azidosulfonylamino)-4-methoxybenzene

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 228.03171 Da
Monoisotopic Mass: 2.7
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]+	229.03899	141.5
[M+Na]+	251.02093	148.5
[M-H]-	227.02443	148.0
[M+NH4]+	246.06553	159.3
[M+K]+	266.99487	141.8
[M+H-H2O]+	211.02897	138.5
[M+HCOO]-	273.02991	168.1
[M+CH3COO]-	287.04556	189.5
[M+Na-2H]-	249.00638	152.3
[M]+	228.03116	141.6
[M]-	228.03226	141.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe