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3-amino-2,5-xylenesulfonic acid, monohydrate
SpectraBase Compound ID AwrGO9si4na
InChI InChI=1S/C8H11NO3S.H2O/c1-5-3-7(9)6(2)8(4-5)13(10,11)12;/h3-4H,9H2,1-2H3,(H,10,11,12);1H2
InChIKey JZKCRQMDAWXBOR-UHFFFAOYSA-N
Mol Weight 219.25 g/mol
Molecular Formula C8H13NO4S
Exact Mass 219.056529 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID DHrisDFVgng
Name 3-AMINO-2,5-XYLENESULFONIC ACID, MONOHYDRATE
Source of Sample A. COURTIN, SANDOZ AG, BASEL, SWITZERLAND
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H13NO4S
InChI InChI=1S/C8H11NO3S.H2O/c1-5-3-7(9)6(2)8(4-5)13(10,11)12;/h3-4H,9H2,1-2H3,(H,10,11,12);1H2
InChIKey JZKCRQMDAWXBOR-UHFFFAOYSA-N
Literature Reference HELV. CHIM. ACTA 60, 19(1977) Abstract-Chemical Abstracts= 86, 171016(1977)
Molecular Weight 219.255005
Synonyms 2,5-XYLENESULFONIC ACID, 3-AMINO-, MONOHYDRATE
Technique KBr WAFER