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3-{[1,1-bis(hydroxymethyl)-2-hydroxyethyl]amino}-2-hydroxy-1-propanesulfonic acid

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3-{[1,1-bis(hydroxymethyl)-2-hydroxyethyl]amino}-2-hydroxy-1-propanesulfonic acid
SpectraBase Compound ID 2yO6ulJPau4
InChI InChI=1S/C7H17NO7S/c9-3-7(4-10,5-11)8-1-6(12)2-16(13,14)15/h6,8-12H,1-5H2,(H,13,14,15)
InChIKey RZQXOGQSPBYUKH-UHFFFAOYSA-N
Mol Weight 259.27 g/mol
Molecular Formula C7H17NO7S
Exact Mass 259.072573 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KATHPM2NF4S
Name 3-[1,1-BIS(HYDROXYMETHYL)-2-HYDROXYETHYL]-2-HYDROXY-1-PROPANESULFONIC ACID
Source of Sample Fluka AG, Buchs, Switzerland
CAS Registry Number 68399-81-5
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H17NO7S
InChI InChI=1S/C7H17NO7S/c9-3-7(4-10,5-11)8-1-6(12)2-16(13,14)15/h6,8-12H,1-5H2,(H,13,14,15)
InChIKey RZQXOGQSPBYUKH-UHFFFAOYSA-N
Molecular Weight 259.28
Solvent Deuterium oxide/NaOD; Reference=Dioxane Spectrometer= Varian CFT-20