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2-[5-Isopropenyl-2-(3-methoxyallyl)-2-methyl-3-oxo-cyclohexyl]-6-methoxy-3,4-dihydro-2H-naphthalen-1-one
SpectraBase Compound ID 9j20c5UdM1m
InChI InChI=1S/C25H32O4/c1-16(2)18-14-22(25(3,23(26)15-18)11-6-12-28-4)21-9-7-17-13-19(29-5)8-10-20(17)24(21)27/h6,8,10,12-13,18,21-22H,1,7,9,11,14-15H2,2-5H3/b12-6+
InChIKey SXJAAMNSQDTPQA-WUXMJOGZSA-N
Mol Weight 396.5 g/mol
Molecular Formula C25H32O4
Exact Mass 396.23006 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8zxmQ1ttdyV
Name 2-[5-Isopropenyl-2-(3-methoxyallyl)-2-methyl-3-oxo-cyclohexyl]-6-methoxy-3,4-dihydro-2H-naphthalen-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H32O4
InChI InChI=1S/C25H32O4/c1-16(2)18-14-22(25(3,23(26)15-18)11-6-12-28-4)21-9-7-17-13-19(29-5)8-10-20(17)24(21)27/h6,8,10,12-13,18,21-22H,1,7,9,11,14-15H2,2-5H3/b12-6+
InChIKey SXJAAMNSQDTPQA-WUXMJOGZSA-N
Molecular Weight 396.527 g/mol
SMILES C1(C(CCc2cc(ccc12)OC)C1C(C(CC(C1)C(=C)C)=O)(C)C\C=C\OC)=O
SPLASH splash10-004i-0901000000-500ca4344f23953e9a87
Source of Spectrum F-62-1734-31
Synonyms 2-{5-isopropenyl-2-[(2E)-3-methoxy-2-propenyl]-2-methyl-3-oxocyclohexyl}-6-methoxy-3,4-dihydro-1(2H)-naphthalenone
Wiley ID 1632320