CID 165323

Chlorzolamide

Structural Information

Molecular Formula

C₈H₆ClN₃O₂S₂

SMILES

C1=CC=C(C(=C1)C2=NN=C(S2)S(=O)(=O)N)Cl

InChI

InChI=1S/C8H6ClN3O2S2/c9-6-4-2-1-3-5(6)7-11-12-8(15-7)16(10,13)14/h1-4H,(H2,10,13,14)

InChIKey

PZVGOWIIHCUHAO-UHFFFAOYSA-N

Compound name

5-(2-chlorophenyl)-1,3,4-thiadiazole-2-sulfonamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 33
References: 291
Patents: 274.95898 Da
Monoisotopic Mass: 1.6
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]+	275.96626	155.6
[M+Na]+	297.94820	167.6
[M-H]-	273.95170	160.5
[M+NH4]+	292.99280	172.3
[M+K]+	313.92214	161.1
[M+H-H2O]+	257.95624	150.0
[M+HCOO]-	319.95718	164.6
[M+CH3COO]-	333.97283	190.9
[M+Na-2H]-	295.93365	157.3
[M]+	274.95843	159.2
[M]-	274.95953	159.2

Literature stripe

literature stripe

Patent stripe

patents stripe