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Ethyl[5,5,6,6,6-2H5]-5-(Benzyloxy)-3-hydroxy-3-methylpentanoate
SpectraBase Compound ID JEK2R066bQq
InChI InChI=1S/C15H22O4/c1-3-19-14(16)11-15(2,17)9-10-18-12-13-7-5-4-6-8-13/h4-8,17H,3,9-12H2,1-2H3/i2D3,10D2
InChIKey JWHXOHDFTSUPNZ-TYGWEUIGSA-N
Mol Weight 271.37 g/mol
Molecular Formula C15H172D5O4
Exact Mass 271.183193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 44gJLLHHrsC
Name Ethyl[5,5,6,6,6-2H5]-5-(Benzyloxy)-3-hydroxy-3-methylpentanoate
Alternate Name(s) 5,5-Dideuterio-3-hydroxy-5-phenylmethoxy-3-(trideuteriomethyl)pentanoic acid ethyl ester Ethyl 5,5-dideuterio-3-hydroxy-5-phenylmethoxy-3-(trideuteriomethyl)pentanoate Ethyl 5-benzyloxy-5,5-dideuterio-3-hydroxy-3-(trideuteriomethyl)pentanoate Ethyl 5,5-dideuterio-3-oxidanyl-5-phenylmethoxy-3-(trideuteriomethyl)pentanoate
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Formula C15H17D5O4
InChI InChI=1S/C15H22O4/c1-3-19-14(16)11-15(2,17)9-10-18-12-13-7-5-4-6-8-13/h4-8,17H,3,9-12H2,1-2H3/i2D3,10D2
InChIKey JWHXOHDFTSUPNZ-TYGWEUIGSA-N
Molecular Weight 271.368 g/mol
SMILES OC(CC(=O)OCC)(CC(OCc1ccccc1)([2D])[2D])C([2D])([2D])[2D]
SPLASH splash10-0006-9300000000-0f23eb7541ee166de963
Source of Spectrum U1-2011-3344-8d
Wiley ID 1665687