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2-{1'-[(3",3"-Dimethylcyclohexyl)ethoxy]-2'-oxoethyl} (3,3,3-trideuterio)propanoate
SpectraBase Compound ID 6G6ulPX3PqN
InChI InChI=1S/C15H26O4/c1-5-13(16)18-10-14(17)19-11(2)12-7-6-8-15(3,4)9-12/h11-12H,5-10H2,1-4H3/t11-,12+/m0/s1/i1D3
InChIKey PDUFSBFWOJELLV-GXKHPTSPSA-N
Mol Weight 273.39 g/mol
Molecular Formula C15H232D3O4
Exact Mass 273.20194 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID YAGb6tMAsq
Name 2-{1'-[(3",3"-Dimethylcyclohexyl)ethoxy]-2'-oxoethyl} (3,3,3-trideuterio)propanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H23D3O4
InChI InChI=1S/C15H26O4/c1-5-13(16)18-10-14(17)19-11(2)12-7-6-8-15(3,4)9-12/h11-12H,5-10H2,1-4H3/t11-,12+/m0/s1/i1D3
InChIKey PDUFSBFWOJELLV-GXKHPTSPSA-N
Molecular Weight 273.387 g/mol
SMILES C(O[C@]([C@]1(CC(C)(C)CCC1)[H])(C)[H])(=O)COC(=O)CC([2D])([2D])[2D]
SPLASH splash10-0830-9600000000-0c584bb2b59c445d7a13
Source of Spectrum H-92-1794-22b
Wiley ID 1693706