CID 3551918

14383-24-5

Structural Information

Molecular Formula

C₁₀H₉N₃O₂S

SMILES

CC1=CC(=C(C=C1O)O)N=NC2=NC=CS2

InChI

InChI=1S/C10H9N3O2S/c1-6-4-7(9(15)5-8(6)14)12-13-10-11-2-3-16-10/h2-5,14-15H,1H3

InChIKey

WYTAVGNTSZKJHY-UHFFFAOYSA-N

Compound name

4-methyl-6-(1,3-thiazol-2-yldiazenyl)benzene-1,3-diol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 10
Patents: 235.04155 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]+	236.04883	149.8
[M+Na]+	258.03077	161.4
[M+NH4]+	253.07537	157.8
[M+K]+	274.00471	155.4
[M-H]-	234.03427	153.8
[M+Na-2H]-	256.01622	157.0
[M]+	235.04100	152.9
[M]-	235.04210	152.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe