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(3S,4S)-4-bromo-1,1-dioxidotetrahydro-3-thienyl benzoate

View entire compound with spectra: 1 NMR

(3S,4S)-4-bromo-1,1-dioxidotetrahydro-3-thienyl benzoate
SpectraBase Compound ID DFdEnPmHPeW
InChI InChI=1S/C11H11BrO4S/c12-9-6-17(14,15)7-10(9)16-11(13)8-4-2-1-3-5-8/h1-5,9-10H,6-7H2
InChIKey IMUBPUCHQXODOD-UHFFFAOYSA-N
Mol Weight 319.17 g/mol
Molecular Formula C11H11BrO4S
Exact Mass 317.956143 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID A0UhgBJ0PL3
Name (3S,4S)-4-bromo-1,1-dioxidotetrahydro-3-thienyl benzoate
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/C11H11BrO4S/c12-9-6-17(14,15)7-10(9)16-11(13)8-4-2-1-3-5-8/h1-5,9-10H,6-7H2
InChIKey IMUBPUCHQXODOD-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_15827
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: 987/00002695; Labnumber: 987/00002695218832; VK_ID: VK-015832
Synonyms 4-bromo-1,1-dioxidotetrahydro-3-thienyl benzoate
Temperature 308 °C