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7-[4-Methyl-6-[(2,5-dimethoxy-3-methyl)phenyl]-2-(hydroxy)hex-4-en-1-yl]-6,7,9,9-tetramethylbicyclo[4.2.1]nonane-2,4-diol

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7-[4-Methyl-6-[(2,5-dimethoxy-3-methyl)phenyl]-2-(hydroxy)hex-4-en-1-yl]-6,7,9,9-tetramethylbicyclo[4.2.1]nonane-2,4-diol
SpectraBase Compound ID J37XiHkQ6sL
InChI InChI=1S/C29H46O5/c1-18(9-10-20-13-23(33-7)12-19(2)26(20)34-8)11-21(30)15-28(5)17-24-25(32)14-22(31)16-29(28,6)27(24,3)4/h9,12-13,21-22,24-25,30-32H,10-11,14-17H2,1-8H3/b18-9+
InChIKey FIBIFURMEIWVHA-GIJQJNRQSA-N
Mol Weight 474.7 g/mol
Molecular Formula C29H46O5
Exact Mass 474.334525 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6LjKG5hUGlU
Name 7-[4-Methyl-6-[(2,5-dimethoxy-3-methyl)phenyl]-2-(hydroxy)hex-4-en-1-yl]-6,7,9,9-tetramethylbicyclo[4.2.1]nonane-2,4-diol
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H46O5
InChI InChI=1S/C29H46O5/c1-18(9-10-20-13-23(33-7)12-19(2)26(20)34-8)11-21(30)15-28(5)17-24-25(32)14-22(31)16-29(28,6)27(24,3)4/h9,12-13,21-22,24-25,30-32H,10-11,14-17H2,1-8H3/b18-9+
InChIKey FIBIFURMEIWVHA-GIJQJNRQSA-N
Molecular Weight 474.682 g/mol
SMILES OC1CC(CC2(C(C1CC2(CC(C\C(=C\Cc1c(c(C)cc(c1)OC)OC)C)O)C)(C)C)C)O
SPLASH splash10-00di-0090100000-38f196f9f986145e3211
Source of Spectrum J-60-3331-61
Synonyms 7-[(4E)-6-(2,5-dimethoxy-3-methylphenyl)-2-hydroxy-4-methyl-4-hexenyl]-6,7,9,9-tetramethylbicyclo[4.2.1]nonane-2,4-diol
Wiley ID 1393986