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1-(3,5,5,6,8,8-Hexamethyl-5,6,7,8-tetrahydro-naphthalen-2-yl)-2-(8-methyl-1-oxa-spiro[4.5]dec-2-yloxy)-ethanone
SpectraBase Compound ID 4EVWL7WcWah
InChI InChI=1S/C28H42O3/c1-18-8-11-28(12-9-18)13-10-25(31-28)30-17-24(29)21-15-22-23(14-19(21)2)27(6,7)20(3)16-26(22,4)5/h14-15,18,20,25H,8-13,16-17H2,1-7H3
InChIKey PBLOVDHELPNMRW-UHFFFAOYSA-N
Mol Weight 426.6 g/mol
Molecular Formula C28H42O3
Exact Mass 426.313395 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H4748yOqhBr
Name 1-(3,5,5,6,8,8-Hexamethyl-5,6,7,8-tetrahydro-naphthalen-2-yl)-2-(8-methyl-1-oxa-spiro[4.5]dec-2-yloxy)-ethanone
Appearance Colorless to pale yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H42O3
InChI InChI=1S/C28H42O3/c1-18-8-11-28(12-9-18)13-10-25(31-28)30-17-24(29)21-15-22-23(14-19(21)2)27(6,7)20(3)16-26(22,4)5/h14-15,18,20,25H,8-13,16-17H2,1-7H3
InChIKey PBLOVDHELPNMRW-UHFFFAOYSA-N
Instrument Name Fisons-GC 8000 series
Ionization Type EI
Molecular Weight 426.641 g/mol
SMILES C(COC1OC2(CC1)CCC(CC2)C)(c1cc2C(CC(C(c2cc1C)(C)C)C)(C)C)=O
SPLASH splash10-0f6x-5950000000-aeefef7eeb189ab2127c
Sample Comments mixture of diastereomers, dr = 6:1, dr = 6:1
Source of Spectrum IN243650A1
Wiley ID 1843999