4-(Hydroxymethyl)-2-methyl-5-({[5-(trifluoromethyl)-1H-benzo[d]imidazol-2-yl]thio}methyl)pyridin-3-ol

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Systematic / IUPAC Name: 4-(Hydroxymethyl)-2-methyl-5-({[6-(trifluoromethyl)-1H-benzimidazol-2-yl]sulfanyl}methyl)-3-pyridinol

ID: Reference4279

Other Names: 4-Pyridinemethanol, 3-hydroxy-2-methyl-5-({[6-(trifluoromethyl)-1H-benzimidazol-2-yl]thio}methyl)-

Formula: C16H14F3N3O2S

Spectral Data

4-(Hydroxymethyl)-2-methyl-5-({[5-(trifluoromethyl)-1H-benzo[d]imidazol-2-yl]thio}methyl)pyridin-3-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 2
No. of Spectra 234
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 3/18/2016 9:22:10 AM
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Identificators

InChI InChI=1S/C16H14F3N3O2S/c1-8-14(24)11(6-23)9(5-20-8)7-25-15-21-12-3-2-10(16(17,18)19)4-13(12)22-15/h2-5,23-24H,6-7H2,1H3,(H,21,22)
InChI Key WLUKKTLBTKOTSG-UHFFFAOYSA-N
Canonical SMILES CC1=NC=C(C(=C1O)CO)CSC2=NC3=C(N2)C=C(C=C3)C(F)(F)F
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Other Names 4-Pyridinemethanol, 3-hydroxy-2-methyl-5-({[6-(trifluoromethyl)-1H-benzimidazol-2-yl]thio}methyl)-

In Other Databases

ChemSpider 2077525
PubChem 2798773