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2-IMINO-7-METHOXY-2H-BENZOPYRAN-3-CARBOTHIAMIDE
SpectraBase Compound ID 2loJSwaSMuk
InChI InChI=1S/C11H10N2O2S/c1-14-7-3-2-6-4-8(11(13)16)10(12)15-9(6)5-7/h2-5,12H,1H3,(H2,13,16)
InChIKey NXTBIGNEAVVRSE-UHFFFAOYSA-N
Mol Weight 234.27 g/mol
Molecular Formula C11H10N2O2S
Exact Mass 234.046299 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L7sNcyezkCS
Name 2-IMINO-7-METHOXY-2H-BENZOPYRAN-3-CARBOTHIAMIDE
Compound Number 6C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H10N2O2S
InChI InChI=1S/C11H10N2O2S/c1-14-7-3-2-6-4-8(11(13)16)10(12)15-9(6)5-7/h2-5,12H,1H3,(H2,13,16)
InChIKey NXTBIGNEAVVRSE-UHFFFAOYSA-N
Literature Reference Author C.N.O'CALLAGHAN,T.B.H.MCMURRY,J.E.O'BRIEN
Literature Reference Citation J.CHEM.SOC.PERKIN-2,425(1998)
Literature Reference DOI 10.1039/js8732600425
Molecular Weight 234.273 g/mol
Solvent DMSO-D6
Source File Reference UWRU12037