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2-Methoxy-7-[4-methyl-6-[(2,5-dimethoxy-3-methyl)phenyl]-2-oxohex-4-en-1-yl]-6,7,9,9-tetramethylbicyclo[4.2.1]non2-en-4-one

View entire compound with spectra: 1 MS (GC)

2-Methoxy-7-[4-methyl-6-[(2,5-dimethoxy-3-methyl)phenyl]-2-oxohex-4-en-1-yl]-6,7,9,9-tetramethylbicyclo[4.2.1]non2-en-4-one
SpectraBase Compound ID A5bVbRJXEBI
InChI InChI=1S/C30H42O5/c1-19(10-11-21-14-24(33-7)13-20(2)27(21)35-9)12-22(31)16-29(5)18-25-26(34-8)15-23(32)17-30(29,6)28(25,3)4/h10,13-15,25H,11-12,16-18H2,1-9H3/b19-10+/t25?,29?,30-/m1/s1
InChIKey PWCLDVFOHFIOLS-ZFEUTGFUSA-N
Mol Weight 482.7 g/mol
Molecular Formula C30H42O5
Exact Mass 482.303224 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1t2PhEs0vY
Name 2-Methoxy-7-[4-methyl-6-[(2,5-dimethoxy-3-methyl)phenyl]-2-oxohex-4-en-1-yl]-6,7,9,9-tetramethylbicyclo[4.2.1]non2-en-4-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H42O5
InChI InChI=1S/C30H42O5/c1-19(10-11-21-14-24(33-7)13-20(2)27(21)35-9)12-22(31)16-29(5)18-25-26(34-8)15-23(32)17-30(29,6)28(25,3)4/h10,13-15,25H,11-12,16-18H2,1-9H3/b19-10+/t25?,29?,30-/m1/s1
InChIKey PWCLDVFOHFIOLS-ZFEUTGFUSA-N
Molecular Weight 482.661 g/mol
SMILES [C@]12(C(CC(C2(C)C)C(OC)=CC(C1)=O)(CC(=O)C\C(=C\Cc1c(c(C)cc(c1)OC)OC)C)C)C
SPLASH splash10-0089-0060900000-b4ba1fbe4c38ad5591d8
Source of Spectrum J-60-3332-65
Synonyms (S)-2-Methoxy-7-[4-methyl-6-[(2,5-dimethoxy-3-methyl)phenyl]-2-oxohex-4-en-1-yl]-6,7,9,9-tetramethylbicyclo[4.2.1]non2-en-4-one 8-[(4E)-6-(2,5-dimethoxy-3-methylphenyl)-4-methyl-2-oxo-4-hexenyl]-5-methoxy-1,8,9,9-tetramethylbicyclo[4.2.1]non-4-en-3-one
Wiley ID 1395700