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8-(CARBOXAMIDINYLTHIO)-METHYL-6-METHYL-2-(2-THIENYL)-4H-1-BENZOPYRAN-4-ONE-HYDROBROMYDE

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8-(CARBOXAMIDINYLTHIO)-METHYL-6-METHYL-2-(2-THIENYL)-4H-1-BENZOPYRAN-4-ONE-HYDROBROMYDE
SpectraBase Compound ID 8O7d4ML9E5X
InChI InChI=1S/C16H13BrN2O2S2/c1-9-5-10(8-23-16(18)19-17)15-11(6-9)12(20)7-13(21-15)14-3-2-4-22-14/h2-7H,8H2,1H3,(H2,18,19)
InChIKey MYXIJABVIFSDIR-UHFFFAOYSA-N
Mol Weight 409.32 g/mol
Molecular Formula C16H13BrN2O2S2
Exact Mass 407.960183 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 47cg2dCRzjV
Name 8-(CARBOXAMIDINYLTHIO)-METHYL-6-METHYL-2-(2-THIENYL)-4H-1-BENZOPYRAN-4-ONE-HYDROBROMYDE
Compound Number 15E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H13BrN2O2S2
InChI InChI=1S/C16H13BrN2O2S2/c1-9-5-10(8-23-16(18)19-17)15-11(6-9)12(20)7-13(21-15)14-3-2-4-22-14/h2-7H,8H2,1H3,(H2,18,19)
InChIKey MYXIJABVIFSDIR-UHFFFAOYSA-N
Literature Reference Author R.A.AITKEN,M.C.BIBBY,J.A.DOUBLE,R.M.PHILLIPS,S.K.SHARMA
Literature Reference Citation ARCH.PHARM.,329,489(1996)
Literature Reference DOI 10.1002/ardp.19963291104
Molecular Weight 409.315 g/mol
Solvent CDCl3
Source File Reference UWRU10647