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DL-N-(dichloroacetyl)serine, sodium salt

View entire compound with spectra: 3 NMR, and 1 FTIR

DL-N-(dichloroacetyl)serine, sodium salt
SpectraBase Compound ID HhdaNyFHG07
InChI InChI=1S/C5H7Cl2NO4.Na/c6-3(7)4(10)8-2(1-9)5(11)12;/h2-3,9H,1H2,(H,8,10)(H,11,12);/q;+1/p-1
InChIKey RETAOVSRPQQHSS-UHFFFAOYSA-M
Mol Weight 238.00176928 g/mol
Molecular Formula C5H6Cl2NNaO4
Exact Mass 236.957157 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID A55yDWIBatV
Name sodium 2-[(dichloroacetyl)amino]-3-hydroxypropanoate
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/C5H7Cl2NO4.Na/c6-3(7)4(10)8-2(1-9)5(11)12;/h2-3,9H,1H2,(H,8,10)(H,11,12);/q;+1/p-1
InChIKey RETAOVSRPQQHSS-UHFFFAOYSA-M
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_16507
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: 987/00003964; Labnumber: 987/00003964218848; VK_ID: VK-016512
Temperature 318 °C