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3-Methyl-6-[(7E,9E)-2-oxidanylundeca-7,9-dienyl]-4-(trideuteriomethoxy)pyran-2-one
SpectraBase Compound ID E0mQ4Jhr81i
InChI InChI=1S/C18H26O4/c1-4-5-6-7-8-9-10-11-15(19)12-16-13-17(21-3)14(2)18(20)22-16/h4-7,13,15,19H,8-12H2,1-3H3/b5-4+,7-6+/i3D3
InChIKey XDMCDVWBAFHJIV-WDCFUBMKSA-N
Mol Weight 309.42 g/mol
Molecular Formula C18H23D3O4
Exact Mass 309.20194 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IieEVDghwRl
Name 3-Methyl-6-[(7E,9E)-2-oxidanylundeca-7,9-dienyl]-4-(trideuteriomethoxy)pyran-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H23D3O4
InChI InChI=1S/C18H26O4/c1-4-5-6-7-8-9-10-11-15(19)12-16-13-17(21-3)14(2)18(20)22-16/h4-7,13,15,19H,8-12H2,1-3H3/b5-4+,7-6+/i3D3
InChIKey XDMCDVWBAFHJIV-WDCFUBMKSA-N
Molecular Weight 309.420 g/mol
SMILES OC(CC1=CC(=C(C(=O)O1)C)OC([D])([D])[D])CCCC\C=C\C=C\C
SPLASH splash10-0a4i-8901000000-180c187a207b7b1b92ce
Source of Spectrum KC-0-1231-24
Synonyms 6-[(7E,9E)-2-hydroxyundeca-7,9-dienyl]-3-methyl-4-(trideuteriomethoxy)-2-pyranone 6-[(7E,9E)-2-hydroxyundeca-7,9-dienyl]-3-methyl-4-(trideuteriomethoxy)pyran-2-one
Wiley ID 827803