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(5.alpha.,10.beta.)-1.beta.-allyl-1.alpha.-methyl-2-decalone
SpectraBase Compound ID 81QPHA5rI0P
InChI InChI=1S/C14H22O/c1-3-10-14(2)12-7-5-4-6-11(12)8-9-13(14)15/h3,11-12H,1,4-10H2,2H3/t11-,12+,14-/m1/s1
InChIKey VRLGHHNHFNQFQH-MBNYWOFBSA-N
Mol Weight 206.33 g/mol
Molecular Formula C14H22O
Exact Mass 206.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AzGaqRZfFGL
Name (5.alpha.,10.beta.)-1.beta.-allyl-1.alpha.-methyl-2-decalone
CAS Registry Number 97571-40-9
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O
InChI InChI=1S/C14H22O/c1-3-10-14(2)12-7-5-4-6-11(12)8-9-13(14)15/h3,11-12H,1,4-10H2,2H3/t11-,12+,14-/m1/s1
InChIKey VRLGHHNHFNQFQH-MBNYWOFBSA-N
Molecular Weight 206.329 g/mol
SMILES [C@@]1([C@@]2([C@@](CCCC2)([H])CCC1=O)[H])(CC=C)C
SPLASH splash10-0a4i-0390000000-8f86b7ab9faa44dc3ec4
Source of Spectrum J-50-4150-0
Synonyms (1R,4aR,8aS)-1-allyl-1-methyloctahydro-2(1H)-naphthalenone
Wiley ID 1205206