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(-)-(3S,4aR,8aS)-3-Bromo-3,4,4a,5,6,7,8,8a-octahydro-4a,8,8-trimethylnaphthalen-2(1H)-one
SpectraBase Compound ID 3i0qj07qCMu
InChI InChI=1S/C13H21BrO/c1-12(2)5-4-6-13(3)8-9(14)10(15)7-11(12)13/h9,11H,4-8H2,1-3H3/t9-,11-,13+/m0/s1
InChIKey ZHWGBSKIZSEBNY-XHVZSJERSA-N
Mol Weight 273.21 g/mol
Molecular Formula C13H21BrO
Exact Mass 272.077578 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BzEtJAfpEV5
Name (-)-(3S,4aR,8aS)-3-Bromo-3,4,4a,5,6,7,8,8a-octahydro-4a,8,8-trimethylnaphthalen-2(1H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H21BrO
InChI InChI=1S/C13H21BrO/c1-12(2)5-4-6-13(3)8-9(14)10(15)7-11(12)13/h9,11H,4-8H2,1-3H3/t9-,11-,13+/m0/s1
InChIKey ZHWGBSKIZSEBNY-XHVZSJERSA-N
Molecular Weight 273.214 g/mol
SMILES [C@]12([C@@](CC([C@](C2)(Br)[H])=O)(C(C)(C)CCC1)[H])C
SPLASH splash10-0903-9400000000-ae3f1f7a065d2725154e
Source of Spectrum F-48-5501-0
Synonyms (3S,4aR,8aS)-3-bromo-4a,8,8-trimethyloctahydro-2(1H)-naphthalenone
Wiley ID 1275896