1-{[5-(Trifluoromethyl)pyridin-2-yl]oxy}-3-{[5-(trifluoromethyl)pyridin-2-yl]thio}propan-2-ol

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Systematic / IUPAC Name: 1-{[5-(Trifluoromethyl)-2-pyridinyl]oxy}-3-{[5-(trifluoromethyl)-2-pyridinyl]sulfanyl}-2-propanol

ID: Reference4806

Other Names: 2-Propanol, 1-{[5-(trifluoromethyl)-2-pyridinyl]oxy}-3-{[5-(trifluoromethyl)-2-pyridinyl]thio}-

Formula: C15H12F6N2O2S

Spectral Data

1-{[5-(Trifluoromethyl)pyridin-2-yl]oxy}-3-{[5-(trifluoromethyl)pyridin-2-yl]thio}propan-2-ol 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 1
No. of Spectra 119
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 5/12/2016 6:49:46 AM
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Identificators

InChI InChI=1S/C15H12F6N2O2S/c16-14(17,18)9-1-3-12(22-5-9)25-7-11(24)8-26-13-4-2-10(6-23-13)15(19,20)21/h1-6,11,24H,7-8H2
InChI Key SUPMWGZLXUFWIL-UHFFFAOYSA-N
Canonical SMILES C1=CC(=NC=C1C(F)(F)F)OCC(CSC2=NC=C(C=C2)C(F)(F)F)O
CAS
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Other Names 2-Propanol, 1-{[5-(trifluoromethyl)-2-pyridinyl]oxy}-3-{[5-(trifluoromethyl)-2-pyridinyl]thio}-

In Other Databases

PubChem 2809220
ChemSpider 2087645