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5,9,13-Pentadecatrien-2-one-1,1,1,3,3-D5, 6,10,14-trimethyl-, (E,E)-
SpectraBase Compound ID 5MaVs3vMBdt
InChI InChI=1S/C18H30O/c1-15(2)9-6-10-16(3)11-7-12-17(4)13-8-14-18(5)19/h9,11,13H,6-8,10,12,14H2,1-5H3/b16-11+,17-13+/i5D3,14D2
InChIKey LTUMRKDLVGQMJU-SYMUOYGDSA-N
Mol Weight 267.47 g/mol
Molecular Formula C18H252D5O
Exact Mass 267.261049 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kmb4FjXS9vT
Name 5,9,13-Pentadecatrien-2-one-1,1,1,3,3-D5, 6,10,14-trimethyl-, (E,E)-
CAS Registry Number 123499-03-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H25D5O
InChI InChI=1S/C18H30O/c1-15(2)9-6-10-16(3)11-7-12-17(4)13-8-14-18(5)19/h9,11,13H,6-8,10,12,14H2,1-5H3/b16-11+,17-13+/i5D3,14D2
InChIKey LTUMRKDLVGQMJU-SYMUOYGDSA-N
Molecular Weight 267.468 g/mol
SMILES C(\C=C\(CC\C=C\(CCC=C(C)C)C)C)C(C(=O)C([2D])([2D])[2D])([2D])[2D]
SPLASH splash10-00ke-9000000000-44ed595227dab85b48ce
Source of Spectrum H-72-252-8
Synonyms 6,10,14-Trimethyl-(1,1,1,3,3-pentadeuterio)pentadeca-5,9,13-triene-2-one
Wiley ID 1266516