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DIPLYNE-C-SULFATE;(15E)-16-BROMOHEXADECA-15-EN-3,5-DIYNE-1,2-DIOL-1-SULFATE

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DIPLYNE-C-SULFATE;(15E)-16-BROMOHEXADECA-15-EN-3,5-DIYNE-1,2-DIOL-1-SULFATE
SpectraBase Compound ID GMGlGKfGLNP
InChI InChI=1S/C16H23BrO5S/c17-14-12-10-8-6-4-2-1-3-5-7-9-11-13-16(18)15-22-23(19,20)21/h12,14,16,18H,1-6,8,10,15H2,(H,19,20,21)/b14-12+
InChIKey HZARHHWAEHHVPW-WYMLVPIESA-N
Mol Weight 407.32 g/mol
Molecular Formula C16H23BrO5S
Exact Mass 406.044958 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4PYsCtCobmk
Name DIPLYNE-C-SULFATE;(15E)-16-BROMOHEXADECA-15-EN-3,5-DIYNE-1,2-DIOL-1-SULFATE
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H23BrO5S
InChI InChI=1S/C16H23BrO5S/c17-14-12-10-8-6-4-2-1-3-5-7-9-11-13-16(18)15-22-23(19,20)21/h12,14,16,18H,1-6,8,10,15H2,(H,19,20,21)/b14-12+
InChIKey HZARHHWAEHHVPW-WYMLVPIESA-N
Literature Reference Author M.L.LERCH,M.K.HARPER,D.J.FAULKNER
Literature Reference Citation J.NAT.PROD.,66,667(2003)
Literature Reference DOI 10.1021/np020544+
Molecular Weight 407.320 g/mol
Solvent CD3OD