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(4S,4aS,8aS)-1,2,3,4,4a,5,8,8a-Octahydro-3,3,4-trideuterio-4-[(trideuterio)methyl]-4,8a-dimethylnaphthalen-4a-ol
SpectraBase Compound ID Gg7kcOXo9j9
InChI InChI=1S/C12H20O/c1-10-6-5-8-11(2)7-3-4-9-12(10,11)13/h3-4,10,13H,5-9H2,1-2H3/t10-,11+,12-/m0/s1/i1D3,6D2,10D
InChIKey COFTVDLZYIBNEL-UJHSGLFYSA-N
Mol Weight 186.33 g/mol
Molecular Formula C12H14D6O
Exact Mass 186.189076 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DOXpMSrlww1
Name (4S,4aS,8aS)-1,2,3,4,4a,5,8,8a-Octahydro-3,3,4-trideuterio-4-[(trideuterio)methyl]-4,8a-dimethylnaphthalen-4a-ol
Alternate Name(s) (4S,4aS,8aS)-1,2,3,4,4a,5,8,8a-Octahydro-3,3,4-trideuterio-4-[(trideuterio)methyl]-8a-methylnaphthalen-4a-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14D6O
InChI InChI=1S/C12H20O/c1-10-6-5-8-11(2)7-3-4-9-12(10,11)13/h3-4,10,13H,5-9H2,1-2H3/t10-,11+,12-/m0/s1/i1D3,6D2,10D
InChIKey COFTVDLZYIBNEL-UJHSGLFYSA-N
Molecular Weight 186.328 g/mol
SMILES O[C@]12[C@](CC=CC2)(CCC([C@@]1(C([D])([D])[D])[D])([D])[D])C
SPLASH splash10-053f-9400000000-5cbc0d5b8ee6027d7f2d
Source of Spectrum H-76-2549-0
Wiley ID 1177023