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Ethyl[6,6,6-2H3]-5-(Benzyloxy)-3-hydroxy-3-methylpentanoate
SpectraBase Compound ID IEsoTAidBdb
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
InChIKey JWHXOHDFTSUPNZ-BMSJAHLVSA-N
Mol Weight 269.36 g/mol
Molecular Formula C15H192D3O4
Exact Mass 269.170639 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9nC2spUpf14
Name Ethyl[6,6,6-2H3]-5-(Benzyloxy)-3-hydroxy-3-methylpentanoate
Alternate Name(s) 3-Hydroxy-5-phenylmethoxy-3-(trideuteriomethyl)pentanoic acid ethyl ester Ethyl 3-hydroxy-5-phenylmethoxy-3-(trideuteriomethyl)pentanoate Ethyl 5-benzyloxy-3-hydroxy-3-(trideuteriomethyl)pentanoate Ethyl 3-oxidanyl-5-phenylmethoxy-3-(trideuteriomethyl)pentanoate
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Formula C15H19D3O4
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
InChIKey JWHXOHDFTSUPNZ-BMSJAHLVSA-N
Molecular Weight 269.355 g/mol
SMILES OC(CC(=O)OCC)(CCOCc1ccccc1)C([2D])([2D])[2D]
SPLASH splash10-0006-9100000000-fb9813eeff95ad22e43f
Source of Spectrum U1-2011-3344-8a
Wiley ID 1665690