N2-[2-(tert-Butylthio)ethyl]-4,6-bis(4-fluorophenoxy)-1,3,5-triazin-2-amine

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Systematic / IUPAC Name: 4,6-Bis(4-fluorophenoxy)-N-{2-[(2-methyl-2-propanyl)sulfanyl]ethyl}-1,3,5-triazin-2-amine

ID: Reference5022

Other Names: 1,3,5-Triazin-2-amine, N-{2-[(1,1-dimethylethyl)thio]ethyl}-4,6-bis(4-fluorophenoxy)-

Formula: C21H22F2N4O2S

Spectral Data

N2-[2-(tert-Butylthio)ethyl]-4,6-bis(4-fluorophenoxy)-1,3,5-triazin-2-amine 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 251
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 6/21/2016 9:56:53 AM
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Identificators

InChI InChI=1S/C21H22F2N4O2S/c1-21(2,3)30-13-12-24-18-25-19(28-16-8-4-14(22)5-9-16)27-20(26-18)29-17-10-6-15(23)7-11-17/h4-11H,12-13H2,1-3H3,(H,24,25,26,27)
InChI Key HKKQBVJWOGRBIT-UHFFFAOYSA-N
Canonical SMILES CC(C)(C)SCCNC1=NC(=NC(=N1)OC2=CC=C(C=C2)F)OC3=CC=C(C=C3)F
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Other Names 1,3,5-Triazin-2-amine, N-{2-[(1,1-dimethylethyl)thio]ethyl}-4,6-bis(4-fluorophenoxy)-

In Other Databases

ChemSpider 2078017
PubChem 2799279