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methyl (2Z)-3,3,3-trifluoro-2-(5-methyl-1,3-benzoxathiol-2-ylidene)propanoate

View entire compound with spectra: 1 NMR

methyl (2Z)-3,3,3-trifluoro-2-(5-methyl-1,3-benzoxathiol-2-ylidene)propanoate
SpectraBase Compound ID L67oU35i5Ss
InChI InChI=1S/C12H9F3O3S/c1-6-3-4-7-8(5-6)19-11(18-7)9(10(16)17-2)12(13,14)15/h3-5H,1-2H3/b11-9-
InChIKey OVTHURJGJPIRKW-LUAWRHEFSA-N
Mol Weight 290.26 g/mol
Molecular Formula C12H9F3O3S
Exact Mass 290.02245 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7PDi3K85kGH
Name methyl (2Z)-3,3,3-trifluoro-2-(5-methyl-1,3-benzoxathiol-2-ylidene)propanoate
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C12H9F3O3S/c1-6-3-4-7-8(5-6)19-11(18-7)9(10(16)17-2)12(13,14)15/h3-5H,1-2H3/b11-9-
InChIKey OVTHURJGJPIRKW-LUAWRHEFSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_319
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: C27602; Labnumber: AKSIN-0046; SBI_ID: SBI-000321
Synonyms methyl 3,3,3-trifluoro-2-(5-methyl-1,3-benzoxathiol-2-ylidene)propanoate
Temperature 306 °C