For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

4-(4-methoxyphenyl)-2-({4-methyl-6,8-dioxabicyclo[3.2.1]octan-2-yl}sulfanyl)-6-(trifluoromethyl)pyrimidine

Compound with spectra: 1 NMR, and 1 MS (GC)

4-(4-methoxyphenyl)-2-({4-methyl-6,8-dioxabicyclo[3.2.1]octan-2-yl}sulfanyl)-6-(trifluoromethyl)pyrimidine
SpectraBase Compound ID 2TpaXflf8j5
InChI InChI=1S/C18H17F3N2O4S/c1-25-10-4-2-9(3-5-10)11-6-15(18(19,20)21)23-17(22-11)28-14-7-12(24)16-26-8-13(14)27-16/h2-6,12-14,16,24H,7-8H2,1H3/t12-,13-,14+,16-/m1/s1
InChIKey VTGVURHSGJTLAM-HGTKMLMNSA-N
Mol Weight 414.4 g/mol
Molecular Formula C18H17F3N2O4S
Exact Mass 414.086113 g/mol
Enantiomer InChIKey VTGVURHSGJTLAM-AYDFFVQHSA-N

View Spectrum of 4-(4-methoxyphenyl)-2-({4-methyl-6,8-dioxabicyclo[3.2.1]octan-2-yl}sulfanyl)-6-(trifluoromethyl)pyrimidine

1H NMR Spectrum
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Solvent DMSO-d6

View Spectrum of 4-(4-methoxyphenyl)-2-({4-methyl-6,8-dioxabicyclo[3.2.1]octan-2-yl}sulfanyl)-6-(trifluoromethyl)pyrimidine

MS (GC) Spectrum
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
  • 2-[[4-(4-methoxyphenyl)-6-(trifluoromethyl)-2-pyrimidinyl]thio]-6,8-dioxabicyclo[3.2.1]octan-4-ol
(1R,2S,5R)-2-((4-(p-tolyl)-6-(trifluoromethyl)pyrimidin-2-yl)thio)-6,8-dioxabicyclo[3.2.1]octan-4-one
(1R,2S,5R)-2-((4-(4-chlorophenyl)-6-(trifluoromethyl)pyrimidin-2-yl)thio)-6,8-dioxabicyclo[3.2.1]octan-4-one
(1R,2S,5R)-2-((4-(4-fluorophenyl)-6-(trifluoromethyl)pyrimidin-2-yl)thio)-6,8-dioxabicyclo[3.2.1]octan-4-one
2-[[4-phenyl-6-(trifluoromethyl)-2-pyrimidinyl]thio]-6,8-dioxabicyclo[3.2.1]octan-4-one
(1R,2S,5R)-2-((4-(difluoromethyl)-6-(p-tolyl)pyrimidin-2-yl)thio)-6,8-dioxabicyclo[3.2.1]octan-4-one
(NZ)-N-[2-[4-(difluoromethyl)-6-phenylpyrimidin-2-yl]sulfanyl-6,8-dioxabicyclo[3.2.1]octan-4-ylidene]hydroxylamine
2-{[4-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-6-(trifluoromethyl)-2-pyrimidinyl]sulfanyl}-N-[(1-methyl-1H-pyrazol-4-yl)methyl]acetamide
4-(2-((4-(4-[Dimethylamino]phenyl)-6-(naphthalen-2-yl)pyrimidin-2-yl)thio)acetamido)-N-(pyridin-4-yl)benzamide
4-Heptafluoropropyl-2,6-diphenylpyrimidine
methyl 4-[2-methyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-5-yl]phenyl ether
Other Resources
Unknown Identification

Search your unknown spectrum against the world's largest collection of reference spectra

KnowItAll Campus Solutions

KnowItAll offers faculty and students at your school access to all the tools you need for spectral analysis and structure drawing & publishing! Plus, access the world's largest spectral library.