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Methyl 10-oxoundecanoate-5,5,6,6-D4

View entire compound with spectra: 1 MS (GC)

Methyl 10-oxoundecanoate-5,5,6,6-D4
SpectraBase Compound ID 82j8xZ2FurJ
InChI InChI=1S/C12H22O3/c1-11(13)9-7-5-3-4-6-8-10-12(14)15-2/h3-10H2,1-2H3/i3D2,4D2
InChIKey TXRMRSKJQBFMRQ-KHORGVISSA-N
Mol Weight 218.33 g/mol
Molecular Formula C12H182D4O3
Exact Mass 218.182002 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EnKv2v00o0I
Name Methyl 10-oxoundecanoate-5,5,6,6-D4
CAS Registry Number 39058-41-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18D4O3
InChI InChI=1S/C12H22O3/c1-11(13)9-7-5-3-4-6-8-10-12(14)15-2/h3-10H2,1-2H3/i3D2,4D2
InChIKey TXRMRSKJQBFMRQ-KHORGVISSA-N
Molecular Weight 218.329 g/mol
SMILES C(=O)(OC)CCCC(C(CCCC(=O)C)([2D])[2D])([2D])[2D]
SPLASH splash10-054o-9400000000-39cb7a9b014d3e845670
Source of Spectrum H-55-2424-4
Wiley ID 1213674