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Djenkolic acid

View entire compound with spectra: 1 NMR

Djenkolic acid
SpectraBase Compound ID 5EbnoSU7qhz
InChI InChI=1S/2C7H14N2O4S2.2Na/c2*8-4(6(10)11)1-14-3-15-2-5(9)7(12)13;;/h2*4-5H,1-3,8-9H2,(H,10,11)(H,12,13);;/q;;2*+1/p-2
InChIKey NPLQKDQICSKOIF-UHFFFAOYSA-L
Mol Weight 552.60153856 g/mol
Molecular Formula C14H26N4Na2O8S4
Exact Mass 552.042887 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1AY7zYUYYkZ
Name 3,3'-(METHYLENEDITHIO)DIALANINE
Source of Sample Fluka AG, Buchs, Switzerland
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H14N2O4S2
InChI InChI=1S/2C7H14N2O4S2.2Na/c2*8-4(6(10)11)1-14-3-15-2-5(9)7(12)13;;/h2*4-5H,1-3,8-9H2,(H,10,11)(H,12,13);;/q;;2*+1/p-2
InChIKey NPLQKDQICSKOIF-UHFFFAOYSA-L
Melting Point 300-350C (dec.)
Molecular Weight 254.33
Solvent Deuterium oxide/NaOD; Reference=Dioxane Spectrometer= Varian CFT-20
Synonyms ALANINE, 3,3'-METHYLENEDITHIODI/-, DJENKOLIC ACID