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3-(N-ethyl-m-toluidino)-2-hydroxy-1-propanesulfonic acid, monosodium salt
SpectraBase Compound ID JU7vHRpxduL
InChI InChI=1S/C12H19NO4S.Na/c1-3-13(8-12(14)9-18(15,16)17)11-6-4-5-10(2)7-11;/h4-7,12,14H,3,8-9H2,1-2H3,(H,15,16,17);/q;+1/p-1
InChIKey IRQRBVOQGUPTLG-UHFFFAOYSA-M
Mol Weight 295.33 g/mol
Molecular Formula C12H18NNaO4S
Exact Mass 295.085424 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AyUdht7JNlY
Name 3-(N-ethyl-m-toluidino)-2-hydroxy-1-propanesulfonic acid, monosodium salt
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Formula C12H18NNaO4S
InChI InChI=1S/C12H19NO4S.Na/c1-3-13(8-12(14)9-18(15,16)17)11-6-4-5-10(2)7-11;/h4-7,12,14H,3,8-9H2,1-2H3,(H,15,16,17);/q;+1/p-1
InChIKey IRQRBVOQGUPTLG-UHFFFAOYSA-M
Instrument Name Varian CFT-20
Sadtler NMR Number 53392M
Solvent Polysol