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2-Butanone, 4-[decahydro-5-(hydroxymethyl)-5,8a-dimethyl-2-methylene-1-naphthalenyl]-, [1S-(1.alpha.,4a.beta.,5.alpha.,8a.alpha.)]-
SpectraBase Compound ID CFDIptcYehB
InChI InChI=1S/C18H30O2/c1-13-6-9-16-17(3,12-19)10-5-11-18(16,4)15(13)8-7-14(2)20/h15-16,19H,1,5-12H2,2-4H3/t15-,16+,17+,18-/m0/s1
InChIKey KDFIUXIPXNKEPM-MLHJIOFPSA-N
Mol Weight 278.44 g/mol
Molecular Formula C18H30O2
Exact Mass 278.22458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CFEVr2wTGDb
Name 2-Butanone, 4-[decahydro-5-(hydroxymethyl)-5,8a-dimethyl-2-methylene-1-naphthalenyl]-, [1S-(1.alpha.,4a.beta.,5.alpha.,8a.alpha.)]-
Alternate Name(s) 4-[(1S,4aS,5S,8aS)-5-(hydroxymethyl)-5,8a-dimethyl-2-methylenedecahydro-1-naphthalenyl]-2-butanone
CAS Registry Number 65894-39-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H30O2
InChI InChI=1S/C18H30O2/c1-13-6-9-16-17(3,12-19)10-5-11-18(16,4)15(13)8-7-14(2)20/h15-16,19H,1,5-12H2,2-4H3/t15-,16+,17+,18-/m0/s1
InChIKey KDFIUXIPXNKEPM-MLHJIOFPSA-N
Molecular Weight 278.436 g/mol
SMILES OC[C@@]1([C@@]2([C@]([C@](C(CC2)=C)(CCC(=O)C)[H])(CCC1)C)[H])C
SPLASH splash10-0006-9770000000-94950a5a5d7315389afe
Source of Spectrum W5-0-0-0
Wiley ID 1282448