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[4-(carboxymethyl)-1,1-dioxidotetrahydro-3-thienyl]acetic acid
SpectraBase Compound ID DZHbD1KAqpk
InChI InChI=1S/C8H12O6S/c9-7(10)1-5-3-15(13,14)4-6(5)2-8(11)12/h5-6H,1-4H2,(H,9,10)(H,11,12)
InChIKey CRCJOBAWARYSAS-UHFFFAOYSA-N
Mol Weight 236.24 g/mol
Molecular Formula C8H12O6S
Exact Mass 236.035459 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CIjY7VfEe03
Name [4-(carboxymethyl)-1,1-dioxidotetrahydro-3-thienyl]acetic acid
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/C8H12O6S/c9-7(10)1-5-3-15(13,14)4-6(5)2-8(11)12/h5-6H,1-4H2,(H,9,10)(H,11,12)
InChIKey CRCJOBAWARYSAS-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_16145
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: D21996; Labnumber: PAR0404; SBI_ID: SBI-016148
Temperature 318 °C