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5,9-Undecadien-2-one-1,1,1,3,3-D5, 6,10-dimethyl-, (E)-
SpectraBase Compound ID 78ZFlNsNgue
InChI InChI=1S/C13H22O/c1-11(2)7-5-8-12(3)9-6-10-13(4)14/h7,9H,5-6,8,10H2,1-4H3/b12-9+/i4D3,10D2
InChIKey HNZUNIKWNYHEJJ-VRIWFRSSSA-N
Mol Weight 199.35 g/mol
Molecular Formula C13H172D5O
Exact Mass 199.198449 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EXnVdFotG09
Name 5,9-Undecadien-2-one-1,1,1,3,3-D5, 6,10-dimethyl-, (E)-
Alternate Name(s) 6,10-Dimethyl-(1,1,1,3,3-pentadeuterio)undeca-5,9-dien-2-one
CAS Registry Number 123499-01-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17D5O
InChI InChI=1S/C13H22O/c1-11(2)7-5-8-12(3)9-6-10-13(4)14/h7,9H,5-6,8,10H2,1-4H3/b12-9+/i4D3,10D2
InChIKey HNZUNIKWNYHEJJ-VRIWFRSSSA-N
Molecular Weight 199.349 g/mol
SMILES C(\C=C\(CCC=C(C)C)C)C(C(=O)C([2D])([2D])[2D])([2D])[2D]
SPLASH splash10-0002-9000000000-c0d9d2e4ff8050edb099
Source of Spectrum H-72-252-5
Wiley ID 1191572