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(1S,3R,4S)-3-(METHOXYMETHOXY)-4-METHYL-1-(PROP-2-YNYL)-HEPT-6-ENYL-2-ALLYL-6-METHOXYBENZOATE
SpectraBase Compound ID zvipcBs9j1
InChI InChI=1S/C24H32O5/c1-7-11-18(4)22(28-17-26-5)16-20(13-9-3)29-24(25)23-19(12-8-2)14-10-15-21(23)27-6/h3,7-8,10,14-15,18,20,22H,1-2,11-13,16-17H2,4-6H3/t18-,20+,22-/m0/s1
InChIKey YIKFJGJOTCJMRF-DWLFOUALSA-N
Mol Weight 400.5 g/mol
Molecular Formula C24H32O5
Exact Mass 400.224974 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4vm5RaJp7m4
Name (1S,3R,4S)-3-(METHOXYMETHOXY)-4-METHYL-1-(PROP-2-YNYL)-HEPT-6-ENYL-2-ALLYL-6-METHOXYBENZOATE
Compound Number 30
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H32O5
InChI InChI=1S/C24H32O5/c1-7-11-18(4)22(28-17-26-5)16-20(13-9-3)29-24(25)23-19(12-8-2)14-10-15-21(23)27-6/h3,7-8,10,14-15,18,20,22H,1-2,11-13,16-17H2,4-6H3/t18-,20+,22-/m0/s1
InChIKey YIKFJGJOTCJMRF-DWLFOUALSA-N
Literature Reference Author C.HERB,F.DETTNER,M.E.MAIER
Literature Reference Citation EUR.J.ORG.CHEM.,728(2005)
Molecular Weight 400.515 g/mol
Sample ID 42378
Solvent CDCl3