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N3-(4-CHLOROBENZOYL)-THYMINE

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N3-(4-CHLOROBENZOYL)-THYMINE
SpectraBase Compound ID 3HiAYBMdVu5
InChI InChI=1S/C12H9ClN2O3/c1-7-6-14-12(18)15(10(7)16)11(17)8-2-4-9(13)5-3-8/h2-6H,1H3,(H,14,18)
InChIKey ZXWBYJQJKDNSIP-UHFFFAOYSA-N
Mol Weight 264.67 g/mol
Molecular Formula C12H9ClN2O3
Exact Mass 264.03017 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FuMfSzcPaNw
Name N3-(4-CHLOROBENZOYL)-THYMINE
Compound Number 8E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H9ClN2O3
InChI InChI=1S/C12H9ClN2O3/c1-7-6-14-12(18)15(10(7)16)11(17)8-2-4-9(13)5-3-8/h2-6H,1H3,(H,14,18)
InChIKey ZXWBYJQJKDNSIP-UHFFFAOYSA-N
Literature Reference Author O.R.LUDEK,C.MEIER
Literature Reference Citation EUR.J.ORG.CHEM.,941(2006)
Molecular Weight 264.668 g/mol
Sample ID 43208
Solvent DMSO-D6