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mercaptoacetic acid, triester with 2-ethyl-2-(hydroxymethyl)-1,3-propanediol
SpectraBase Compound ID 4dFXeCh0RR3
InChI InChI=1S/C12H20O6S3/c1-2-12(6-16-9(13)3-19,7-17-10(14)4-20)8-18-11(15)5-21/h19-21H,2-8H2,1H3
InChIKey KAJBSGLXSREIHP-UHFFFAOYSA-N
Mol Weight 356.47 g/mol
Molecular Formula C12H20O6S3
Exact Mass 356.042202 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KliIvOyRgWe
Name 2-ETHYL-2-(HYDROXYMETHYL)-1,3-PROPANEDIOL, TRIS(MERCAPTOACETATE)
Source of Sample Carlisle Chemical Works, Inc., Reading, Ohio
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20O6S3
InChI InChI=1S/C12H20O6S3/c1-2-12(6-16-9(13)3-19,7-17-10(14)4-20)8-18-11(15)5-21/h19-21H,2-8H2,1H3
InChIKey KAJBSGLXSREIHP-UHFFFAOYSA-N
Molecular Weight 356.48
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms 1,3-PROPANEDIOL, 2-ETHYL-2-/HYDROXYMETHYL/-, TRIS/MERCAPTOACETATE/