CID 15155596

136810-63-4

Structural Information

Molecular Formula

C₃H₇N₃O₂S₂

SMILES

C1CSC(=N1)NS(=O)(=O)N

InChI

InChI=1S/C3H7N3O2S2/c4-10(7,8)6-3-5-1-2-9-3/h1-2H2,(H,5,6)(H2,4,7,8)

InChIKey

CFSSYZATGDLVQN-UHFFFAOYSA-N

Compound name

2-(sulfamoylamino)-4,5-dihydro-1,3-thiazole

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 180.99797 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]+	182.00525	133.8
[M+Na]+	203.98719	142.1
[M-H]-	179.99069	135.6
[M+NH4]+	199.03179	153.7
[M+K]+	219.96113	138.9
[M+H-H2O]+	163.99523	127.9
[M+HCOO]-	225.99617	147.7
[M+CH3COO]-	240.01182	176.3
[M+Na-2H]-	201.97264	136.8
[M]+	180.99742	132.6
[M]-	180.99852	132.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe