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1S,2R,4aS,5R,7R-(Decahydro-7-hydroxy-1,2,4a,5-tetramethyl-1-naphthyl)methyl-3-furanylketone
SpectraBase Compound ID DWCQwsbPqrX
InChI InChI=1S/C20H30O3/c1-13-5-7-19(3)14(2)9-16(21)10-18(19)20(13,4)11-17(22)15-6-8-23-12-15/h6,8,12-14,16,18,21H,5,7,9-11H2,1-4H3/t13-,14-,16-,18?,19+,20+/m1/s1
InChIKey UQLYKSBFEBUUEJ-DCGAGOKDSA-N
Mol Weight 318.46 g/mol
Molecular Formula C20H30O3
Exact Mass 318.219495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3zG28Jkke7z
Name 1S,2R,4aS,5R,7R-(Decahydro-7-hydroxy-1,2,4a,5-tetramethyl-1-naphthyl)methyl-3-furanylketone
Classification Colensane and clerodane diterpenoids
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 318.219494823 u
Formula C20H30O3
InChI InChI=1S/C20H30O3/c1-13-5-7-19(3)14(2)9-16(21)10-18(19)20(13,4)11-17(22)15-6-8-23-12-15/h6,8,12-14,16,18,21H,5,7,9-11H2,1-4H3/t13-,14-,16-,18?,19+,20+/m1/s1
InChIKey UQLYKSBFEBUUEJ-DCGAGOKDSA-N
Molecular Weight 318.457 g/mol
Number of Peaks 9
SMILES O[C@]1(CC2[C@]([C@@](C1)(C)[H])(CC[C@]([C@@]2(CC(c1cocc1)=O)C)(C)[H])C)[H]
SPLASH splash10-0006-9710000000-65812f5ebda1fe713d90
Source of Spectrum FF-6-204-XIV (DOI: 10.1002/ffj.2730060307)
Synonyms 1-(furan-3-yl)-2-((1S,2R,4aS,5R,7R)-7-hydroxy-1,2,4a,5-tetramethyldecahydronaphthalen-1-yl)ethan-1-one
Wiley ID 1801246