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p-isothiocyanatobenzoic acid, ethyl ester
SpectraBase Compound ID 5JhB2rQwHw7
InChI InChI=1S/C10H9NO2S/c1-2-13-10(12)8-3-5-9(6-4-8)11-7-14/h3-6H,2H2,1H3
InChIKey MLOJHUCMCKBDLV-UHFFFAOYSA-N
Mol Weight 207.25 g/mol
Molecular Formula C10H9NO2S
Exact Mass 207.0354 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BGSliL5DSq4
Name p-isothiocyanatobenzoic acid, ethyl ester
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H9NO2S
InChI InChI=1S/C10H9NO2S/c1-2-13-10(12)8-3-5-9(6-4-8)11-7-14/h3-6H,2H2,1H3
InChIKey MLOJHUCMCKBDLV-UHFFFAOYSA-N
Instrument Name Varian A-60D
Sadtler NMR Number 16904M
Solvent CDCl3