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2-[( 13',13',14',14',15',15',16',16',16'-Nonadeuterio-hexadeca-6,11-dien-1'-yl)oxy]-tetrahydropyran
SpectraBase Compound ID IoB792GlMFc
InChI InChI=1S/C21H38O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-19-22-21-18-15-17-20-23-21/h5-6,10-11,21H,2-4,7-9,12-20H2,1H3/b6-5+,11-10+/i1D3,2D2,3D2,4D2
InChIKey KQLYCUGMJQERLI-GHAQDSHZSA-N
Mol Weight 331.59 g/mol
Molecular Formula C21H292D9O2
Exact Mass 331.343671 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A3kA9o0LozA
Name 2-[( 13',13',14',14',15',15',16',16',16'-Nonadeuterio-hexadeca-6,11-dien-1'-yl)oxy]-tetrahydropyran
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Formula C21H29D9O2
InChI InChI=1S/C21H38O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-19-22-21-18-15-17-20-23-21/h5-6,10-11,21H,2-4,7-9,12-20H2,1H3/b6-5+,11-10+/i1D3,2D2,3D2,4D2
InChIKey KQLYCUGMJQERLI-GHAQDSHZSA-N
Molecular Weight 331.588 g/mol
SMILES C1(OCCCC1)OCCCCC\C=C\CCC\C=C\C(C(C(C([2D])([2D])[2D])([2D])[2D])([2D])[2D])([2D])[2D]
SPLASH splash10-014i-9500000000-412b90a483790dff9820
Source of Spectrum U-1994-141-58
Wiley ID 765727