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1,7-ALPHA-DIBROMO-O(4)-METHYLDIHYDROTHEBAINONE-HYDROBROMIDE
SpectraBase Compound ID FScizallF94
InChI InChI=1S/C19H23Br2NO3.BrH/c1-22-5-4-19-9-15(23)13(21)7-11(19)14(22)6-10-12(20)8-16(24-2)18(25-3)17(10)19;/h8,11,13-14H,4-7,9H2,1-3H3;1H/t11?,13-,14+,19-;/m0./s1
InChIKey WSMHYGFZUXWNEC-NGZWAPKKSA-N
Mol Weight 554.12 g/mol
Molecular Formula C19H24Br3NO3
Exact Mass 550.930633 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HRoLGtNPJj7
Name 1,7-ALPHA-DIBROMO-O(4)-METHYLDIHYDROTHEBAINONE-HYDROBROMIDE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H24Br3NO3
InChI InChI=1S/C19H23Br2NO3.BrH/c1-22-5-4-19-9-15(23)13(21)7-11(19)14(22)6-10-12(20)8-16(24-2)18(25-3)17(10)19;/h8,11,13-14H,4-7,9H2,1-3H3;1H/t11?,13-,14+,19-;/m0./s1
InChIKey WSMHYGFZUXWNEC-NGZWAPKKSA-N
Literature Reference Author C.OLIEMAN,L.MAAT,H.C.BEYERMAN
Literature Reference Citation REC.TR.CH.P.-B.,97,31(1978)
Literature Reference DOI 10.1002/recl.19780970202
Molecular Weight 554.116 g/mol
Solvent CD3COOH
Source File Reference UWCS6400