CID 23583981

952234-36-5

Structural Information

Molecular Formula

C₃H₃N₅O₂S

SMILES

C1=CN(C=N1)S(=O)(=O)N=[N+]=[N-]

InChI

InChI=1S/C3H3N5O2S/c4-6-7-11(9,10)8-2-1-5-3-8/h1-3H

InChIKey

GFRDSYFROJUKBF-UHFFFAOYSA-N

Compound name

N-diazoimidazole-1-sulfonamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 12
References: 1058
Patents: 173.00075 Da
Monoisotopic Mass: 0.9
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]+	174.00803	129.1
[M+Na]+	195.98997	138.4
[M-H]-	171.99347	133.8
[M+NH4]+	191.03457	148.7
[M+K]+	211.96391	132.7
[M+H-H2O]+	155.99801	126.2
[M+HCOO]-	217.99895	154.3
[M+CH3COO]-	232.01460	174.8
[M+Na-2H]-	193.97542	140.0
[M]+	173.00020	128.4
[M]-	173.00130	128.4

Literature stripe

literature stripe

Patent stripe

patents stripe