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D-3-mercaptovaline
SpectraBase Compound ID 9AACXIEJxVV
InChI InChI=1S/2C5H11NO2S.Na/c2*1-5(2,9)3(6)4(7)8;/h2*3,9H,6H2,1-2H3,(H,7,8);/q;;+1/p-1
InChIKey VMYKHAVMWSKLED-UHFFFAOYSA-M
Mol Weight 320.4 g/mol
Molecular Formula C10H21N2NaO4S2
Exact Mass 320.084044 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CkLBxMLAizY
Name D-3-MERCAPTOVALINE
Source of Sample Fluka AG, Buchs, Switzerland
CAS Registry Number 52-67-5
Comments Impurities
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H11NO2S
InChI InChI=1S/2C5H11NO2S.Na/c2*1-5(2,9)3(6)4(7)8;/h2*3,9H,6H2,1-2H3,(H,7,8);/q;;+1/p-1
InChIKey VMYKHAVMWSKLED-UHFFFAOYSA-M
Melting Point 214-217C (dec.)
Molecular Weight 149.21
Solvent Deuterium oxide/NaOD; Reference=Dioxane Spectrometer= Varian CFT-20
Synonyms VALINE, 3-MERCAPTO-, D-, PENICILLAMINE, D-,