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p-NITROTHIOBENZOIC ACID, S-OCTYL ESTER
SpectraBase Compound ID K2nXBMOFxrs
InChI InChI=1S/C15H21NO3S/c1-2-3-4-5-6-7-12-20-15(17)13-8-10-14(11-9-13)16(18)19/h8-11H,2-7,12H2,1H3
InChIKey DFSIAYUMAMACKY-UHFFFAOYSA-N
Mol Weight 295.4 g/mol
Molecular Formula C15H21NO3S
Exact Mass 295.124215 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GNBA4fa2VoV
Name p-NITROTHIOBENZOIC ACID, S-OCTYL ESTER
Source of Sample M. Dymicky, U. S. Department of Agriculture, Philadelphia, Pennsylvania
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H21NO3S
InChI InChI=1S/C15H21NO3S/c1-2-3-4-5-6-7-12-20-15(17)13-8-10-14(11-9-13)16(18)19/h8-11H,2-7,12H2,1H3
InChIKey DFSIAYUMAMACKY-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 31.5-32C
Molecular Weight 295.40
Solvent CDCl3; Reference=TMS; Temperature 297K