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p-toluenesulfonic acid, anhydride with isocyanic acid

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p-toluenesulfonic acid, anhydride with isocyanic acid
SpectraBase Compound ID I9h012hkT1Y
InChI InChI=1S/C8H7NO3S/c1-7-2-4-8(5-3-7)13(11,12)9-6-10/h2-5H,1H3
InChIKey VLJQDHDVZJXNQL-UHFFFAOYSA-N
Mol Weight 197.21 g/mol
Molecular Formula C8H7NO3S
Exact Mass 197.014664 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8ILO6RIgz84
Name p-TOLUENESULFONIC ACID, ANHYDRIDE WITH ISOCYANIC ACID
Source of Sample Eastman Organic Chemicals, Rochester, New York
Boiling Point 144C/10mm
Comments Tentative assignment
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H7NO3S
InChI InChI=1S/C8H7NO3S/c1-7-2-4-8(5-3-7)13(11,12)9-6-10/h2-5H,1H3
InChIKey VLJQDHDVZJXNQL-UHFFFAOYSA-N
Molecular Weight 197.21
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms P-TOLUENESULFONIC ACID, ANHYDRIDE WITH ISOCYANIC ACID ISOCYANIC ACID, ANHYDRIDE WITH P-TOLUENESULFONIC ACID