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3-(N-ETHYL-3-HYDROXY-4-NITROSOANILINO)-1-PROPANESULFONIC ACID
SpectraBase Compound ID BUGC3uUQaTC
InChI InChI=1S/2C11H16N2O5S.Na/c2*1-2-13(6-3-7-19(16,17)18)9-4-5-10(12-15)11(14)8-9;/h2*4-5,8,14H,2-3,6-7H2,1H3,(H,16,17,18);/q;;+1/p-1
InChIKey SEEXTPJKPFCULA-UHFFFAOYSA-M
Mol Weight 598.62 g/mol
Molecular Formula C22H31N4NaO10S2
Exact Mass 598.13793 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ExopdRBAPTV
Name 3-(N-ETHYL-3-HYDROXY-4-NITROSOANILINO)-1-PROPANESULFONIC ACID
Source of Sample Fluka AG, Buchs, Switzerland
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16N2O5S
InChI InChI=1S/2C11H16N2O5S.Na/c2*1-2-13(6-3-7-19(16,17)18)9-4-5-10(12-15)11(14)8-9;/h2*4-5,8,14H,2-3,6-7H2,1H3,(H,16,17,18);/q;;+1/p-1
InChIKey SEEXTPJKPFCULA-UHFFFAOYSA-M
Molecular Weight 288.32
Solvent Deuterium oxide/NaOD; Reference=Dioxane Spectrometer= Varian CFT-20
Synonyms 1-PROPANESULFONIC ACID, 3-/N-ETHYL- 3-HYDROXY-4-NITROSOANILINO/-,