CID 82059169

3-((5-methylthiazol-2-yl)amino)phenol

Structural Information

Molecular Formula
C10H10N2OS
SMILES
CC1=CN=C(S1)NC2=CC(=CC=C2)O
InChI
InChI=1S/C10H10N2OS/c1-7-6-11-10(14-7)12-8-3-2-4-9(13)5-8/h2-6,13H,1H3,(H,11,12)
InChIKey
CNBIXXQQXGANHS-UHFFFAOYSA-N
Compound name
3-[(5-methyl-1,3-thiazol-2-yl)amino]phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

206.05139 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.058666 141.4
[M+Na]+ 229.040608 150.9
[M-H]- 205.044114 146.6
[M+NH4]+ 224.085213 160.9
[M+K]+ 245.014548 146.6
[M+H-H2O]+ 189.048650 134.9
[M+HCOO]- 251.049591 161.4
[M+CH3COO]- 265.065241 154.9
[M+Na-2H]- 227.026056 144.6
[M]+ 206.05084142 142.5
[M]- 206.05193858 142.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.