4-Hydroxy-3-{2-[6-methyl-2-(trifluoromethyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-5-yl]-2-oxoethyl}-2H-chromen-2-one

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Systematic / IUPAC Name: 4-Hydroxy-3-{2-[6-methyl-2-(trifluoromethyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-5-yl]-2-oxoethyl}-2H-chromen-2-one

ID: Reference4180

Other Names: 4-Hydroxy-3-{2-[6-methyl-2-(trifluoromethyl)-[1,2,4]triazolo[3,2-b][1,3]thiazol-5-yl]-2-oxoethyl}-2H-chromen-2-one

Formula: C17H10F3N3O4S

Spectral Data

4-Hydroxy-3-{2-[6-methyl-2-(trifluoromethyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-5-yl]-2-oxoethyl}-2H-chromen-2-one mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 2
No. of Spectra 224
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 3/14/2016 8:41:16 AM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C17H10F3N3O4S/c1-7-13(28-16-21-15(17(18,19)20)22-23(7)16)10(24)6-9-12(25)8-4-2-3-5-11(8)27-14(9)26/h2-5,25H,6H2,1H3
InChI Key CQBBCBWPEJUYCY-UHFFFAOYSA-N
Canonical SMILES CC1=C(SC2=NC(=NN12)C(F)(F)F)C(=O)CC3=C(C4=CC=CC=C4OC3=O)O
CAS
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Other Names 4-Hydroxy-3-{2-[6-methyl-2-(trifluoromethyl)-[1,2,4]triazolo[3,2-b][1,3]thiazol-5-yl]-2-oxoethyl}-2H-chromen-2-one

In Other Databases

ChemSpider 17926783
PubChem 54684639