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5-tert-Butyl 1,2-dimethyl 3,3-dimethylpentane-1,2,5-tricarboxylate
SpectraBase Compound ID 3nXeQWGJec9
InChI InChI=1S/C16H28O6/c1-15(2,3)22-12(17)8-9-16(4,5)11(14(19)21-7)10-13(18)20-6/h11H,8-10H2,1-7H3
InChIKey KHXWMKLYZNSMIN-UHFFFAOYSA-N
Mol Weight 316.39 g/mol
Molecular Formula C16H28O6
Exact Mass 316.188589 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1CZwquBops
Name 5-tert-Butyl 1,2-dimethyl 3,3-dimethylpentane-1,2,5-tricarboxylate
Appearance Colorless oil
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Exact Mass 316.188588616 u
Formula C16H28O6
InChI InChI=1S/C16H28O6/c1-15(2,3)22-12(17)8-9-16(4,5)11(14(19)21-7)10-13(18)20-6/h11H,8-10H2,1-7H3
InChIKey KHXWMKLYZNSMIN-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/chem.201701865
Molecular Weight 316.394 g/mol
Quality 147
Reported Formula C16H28O6
SMILES C(OC(=O)CCC(C(C(OC)=O)CC(OC)=O)(C)C)(C)(C)C
SPLASH splash10-07dk-6940000000-fab571fa04f220977775
Source of Spectrum QE-23-SM13-3a (DOI: 10.1002/chem.201701865)
Wiley ID 1905565