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Methyl 5-methyl-6-[(2E,4E)-trideca-2,4-dien-2-yl]pyran-2-acetate
SpectraBase Compound ID BzCBHgAzR2O
InChI InChI=1S/C22H38O3/c1-5-6-7-8-9-10-11-12-13-14-18(2)22-19(3)15-16-20(25-22)17-21(23)24-4/h12-14,19-20,22H,5-11,15-17H2,1-4H3/b13-12+,18-14+/t19-,20+,22+/m0/s1
InChIKey YXUBXGFGVJCJEX-DCKGVWPISA-N
Mol Weight 350.5 g/mol
Molecular Formula C22H38O3
Exact Mass 350.282095 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7blE4MZFw20
Name Methyl 5-methyl-6-[(2E,4E)-trideca-2,4-dien-2-yl]pyran-2-acetate
Alternate Name(s) (2R,5S,6S)-Methyl 5-methyl-6-[(2E,4E)-trideca-2,4-dien-2-yl]pyran-2-acetate Methyl {5-methyl-6-[(1E,3E)-1-methyl-1,3-dodecadienyl]tetrahydro-2H-pyran-2-yl}acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H38O3
InChI InChI=1S/C22H38O3/c1-5-6-7-8-9-10-11-12-13-14-18(2)22-19(3)15-16-20(25-22)17-21(23)24-4/h12-14,19-20,22H,5-11,15-17H2,1-4H3/b13-12+,18-14+/t19-,20+,22+/m0/s1
InChIKey YXUBXGFGVJCJEX-DCKGVWPISA-N
Molecular Weight 350.543 g/mol
SMILES [C@]1(O[C@](CC(=O)OC)([H])CC[C@@]1(C)[H])(\C(=C\C=C\CCCCCCCC)C)[H]
SPLASH splash10-0002-5409000000-2daffdeb6ba27823f290
Source of Spectrum KC-0-798-27
Wiley ID 824912