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2,3-Dihydro-thieno[3,4-b][1,4]dioxine-5,7-dicarboxylic acid monoethyl ester
SpectraBase Compound ID ERblchFTsCP
InChI InChI=1S/C10H10O6S/c1-2-14-10(13)8-6-5(15-3-4-16-6)7(17-8)9(11)12/h2-4H2,1H3,(H,11,12)
InChIKey PDGLGMXUCZAOLI-UHFFFAOYSA-N
Mol Weight 258.24 g/mol
Molecular Formula C10H10O6S
Exact Mass 258.019809 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JV73mKCHtP5
Name thieno[3,4-b][1,4]dioxin-5,7-dicarboxylic acid, 2,3-dihydro-, 5-ethylester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 258.019809210 u
Formula C10H10O6S
InChI InChI=1S/C10H10O6S/c1-2-14-10(13)8-6-5(15-3-4-16-6)7(17-8)9(11)12/h2-4H2,1H3,(H,11,12)
InChIKey PDGLGMXUCZAOLI-UHFFFAOYSA-N
Molecular Weight 258.244 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_15307
Solvent DMSO-d6
Source Vendor ID: NMR/10301789; Lab Info: JI; Lab Number: JI-S000023