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2-Methyl-2-(4,10-dimethyl-5-hydroxy-7-isopropenyl-8-phenylsulfonyl-13-tetrahydropyranoxy)-3E,9E-tridecadienyl-1,3-dioxolane

View entire compound with spectra: 1 MS (GC)

2-Methyl-2-(4,10-dimethyl-5-hydroxy-7-isopropenyl-8-phenylsulfonyl-13-tetrahydropyranoxy)-3E,9E-tridecadienyl-1,3-dioxolane
SpectraBase Compound ID 2pY1LDUdgQg
InChI InChI=1S/C33H50O7S/c1-25(2)30(24-31(34)27(4)12-9-17-33(5)39-21-22-40-33)32(41(35,36)29-13-7-6-8-14-29)23-26(3)11-10-18-38-28-15-19-37-20-16-28/h6-8,12-14,23,28,30-32,34H,1,9-11,15-22,24H2,2-5H3/b26-23+,27-12+
InChIKey AWYAWGMHNXQYBZ-NEMAZPSUSA-N
Mol Weight 590.8 g/mol
Molecular Formula C33H50O7S
Exact Mass 590.327725 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6nVo9Oeb4vu
Name 2-Methyl-2-(4,10-dimethyl-5-hydroxy-7-isopropenyl-8-phenylsulfonyl-13-tetrahydropyranoxy)-3E,9E-tridecadienyl-1,3-dioxolane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H50O7S
InChI InChI=1S/C33H50O7S/c1-25(2)30(24-31(34)27(4)12-9-17-33(5)39-21-22-40-33)32(41(35,36)29-13-7-6-8-14-29)23-26(3)11-10-18-38-28-15-19-37-20-16-28/h6-8,12-14,23,28,30-32,34H,1,9-11,15-22,24H2,2-5H3/b26-23+,27-12+
InChIKey AWYAWGMHNXQYBZ-NEMAZPSUSA-N
Molecular Weight 590.816 g/mol
SMILES OC(\C(=C\CCC1(OCCO1)C)C)CC(C(S(=O)(=O)c1ccccc1)\C=C\(CCCOC1CCOCC1)C)C(=C)C
SPLASH splash10-0fmr-9220000000-e73e7a09f147161af77f
Source of Spectrum QA-46-599-18
Wiley ID 863117