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5'-BROMO-2'-HYDROXY-2-MERCAPTO-4'-METHYLBUTYROPHENONE, 2-(1-PIPERIDINECARBODITHIOATE)
SpectraBase Compound ID GeYq7qYLzeP
InChI InChI=1S/C17H22BrNO2S2/c1-3-15(23-17(22)19-7-5-4-6-8-19)16(21)12-10-13(18)11(2)9-14(12)20/h9-10,15,20H,3-8H2,1-2H3
InChIKey SOTPQRDQCHZCJI-UHFFFAOYSA-N
Mol Weight 416.39 g/mol
Molecular Formula C17H22BrNO2S2
Exact Mass 415.027534 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HotVChu4TDA
Name 5'-BROMO-2'-HYDROXY-2-MERCAPTO-4'-METHYLBUTYROPHENONE, 2-(1-PIPERIDINECARBODITHIOATE)
Source of Sample A. Cascaval, "Al. I. CUZA" University of Iassy, Iasi, Romania
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22BrNO2S2
InChI InChI=1S/C17H22BrNO2S2/c1-3-15(23-17(22)19-7-5-4-6-8-19)16(21)12-10-13(18)11(2)9-14(12)20/h9-10,15,20H,3-8H2,1-2H3
InChIKey SOTPQRDQCHZCJI-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 100-101C
Molecular Weight 416.40
Solvent CDCl3; Reference=TMS; Temperature 297K