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Methyl 8,8,9,9,11,11,12,12-Octadeuterio-tridec-6-ene-1-carboxylate
SpectraBase Compound ID GZYwP4mlxGY
InChI InChI=1S/C15H28O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15(16)17-2/h8-9H,3-7,10-14H2,1-2H3/b9-8+/i3D2,4D2,6D2,7D2
InChIKey IWXVCJGSCBUTCJ-OCQXIWQZSA-N
Mol Weight 248.44 g/mol
Molecular Formula C15H202D8O2
Exact Mass 248.259144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2ZXXd1cdo0Y
Name Methyl 8,8,9,9,11,11,12,12-octadeuteriotridec-6-ene-1-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H20D8O2
InChI InChI=1S/C15H28O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15(16)17-2/h8-9H,3-7,10-14H2,1-2H3/b9-8+/i3D2,4D2,6D2,7D2
InChIKey IWXVCJGSCBUTCJ-OCQXIWQZSA-N
Molecular Weight 248.436 g/mol
SMILES C(CCCC\C=C\C(C(CC(C(C)([2D])[2D])([2D])[2D])([2D])[2D])([2D])[2D])C(=O)OC
SPLASH splash10-00di-9020000000-a8ecafbf149b070c565e
Source of Spectrum U-1994-138-39
Wiley ID 765527