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HEMIBASTADINOL-1

View entire compound with spectra: 2 NMR

HEMIBASTADINOL-1
SpectraBase Compound ID 49ojU4ggbqs
InChI InChI=1S/C17H17Br2NO4/c18-12-7-10(1-3-14(12)21)5-6-20-17(24)16(23)9-11-2-4-15(22)13(19)8-11/h1-4,7-8,16,21-23H,5-6,9H2,(H,20,24)/t16-/m0/s1
InChIKey XDXWMGYLNXERJK-INIZCTEOSA-N
Mol Weight 459.13 g/mol
Molecular Formula C17H17Br2NO4
Exact Mass 456.952434 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4NEneGKGnhJ
Name HEMIBASTADINOL-1
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H17Br2NO4
InChI InChI=1S/C17H17Br2NO4/c18-12-7-10(1-3-14(12)21)5-6-20-17(24)16(23)9-11-2-4-15(22)13(19)8-11/h1-4,7-8,16,21-23H,5-6,9H2,(H,20,24)/t16-/m0/s1
InChIKey XDXWMGYLNXERJK-INIZCTEOSA-N
Literature Reference Author G.R.PETTIT,M.S.BUTLER,M.D.WILLIAMS,M.J.FILIATRAULT,R.K.PETIT
Literature Reference Citation J.NAT.PROD.,59,927(1996)
Literature Reference DOI 10.1021/np960249n
Molecular Weight 459.134 g/mol
Solvent PYRIDINE-D5
Source File Reference UWVP730