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beta-hydroxy-4-(2-hydroxyethyl)-1-piperrazinepropanesulfonic acid, hydrate

View entire compound with spectra: 2 NMR, and 1 FTIR

beta-hydroxy-4-(2-hydroxyethyl)-1-piperrazinepropanesulfonic acid, hydrate
SpectraBase Compound ID 40Ubr6G68Ur
InChI InChI=1S/C9H20N2O5S.H2O/c12-6-5-10-1-3-11(4-2-10)7-9(13)8-17(14,15)16;/h9,12-13H,1-8H2,(H,14,15,16);1H2
InChIKey NRTJJCXOPPWNFG-UHFFFAOYSA-N
Mol Weight 286.343 g/mol
Molecular Formula C9H22N2O6S
Exact Mass 286.119858 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9P56RCgQlXk
Name beta-HYDROXY-4-(2-HYDROXYETHYL)-1-PIPERAZINEPROPANESULFONIC ACID,HYDRATE
Source of Sample Fluka AG, Buchs, Switzerland
CAS Registry Number 68399-78-0
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H20N2O5S H2O
InChI InChI=1S/C9H20N2O5S.H2O/c12-6-5-10-1-3-11(4-2-10)7-9(13)8-17(14,15)16;/h9,12-13H,1-8H2,(H,14,15,16);1H2
InChIKey NRTJJCXOPPWNFG-UHFFFAOYSA-N
Molecular Weight 286.35
Solvent Deuterium oxide; Reference=Dioxane Spectrometer= Varian CFT-20
Synonyms 1-PIPERAZINEPROPANESULFONIC ACID, B-HYDROXY-4-/2-HYDROXYETHYL/-, HYDRATE