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5-tert-Butyl 1,2-dimethyl 3-methylpentane-1,2,5-tricarboxylate
SpectraBase Compound ID B6lFCCjwG2f
InChI InChI=1S/C15H26O6/c1-10(7-8-12(16)21-15(2,3)4)11(14(18)20-6)9-13(17)19-5/h10-11H,7-9H2,1-6H3
InChIKey VPFXOQFNNKRCLE-UHFFFAOYSA-N
Mol Weight 302.37 g/mol
Molecular Formula C15H26O6
Exact Mass 302.172939 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E4LY7eBBXKH
Name 5-tert-Butyl 1,2-dimethyl 3-methylpentane-1,2,5-tricarboxylate
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 302.172938551 u
Formula C15H26O6
InChI InChI=1S/C15H26O6/c1-10(7-8-12(16)21-15(2,3)4)11(14(18)20-6)9-13(17)19-5/h10-11H,7-9H2,1-6H3
InChIKey VPFXOQFNNKRCLE-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/chem.201701865
Quality 112
Reported Formula C15H26O6
SMILES C(OC(=O)CCC(C(CC(=O)OC)C(=O)OC)C)(C)(C)C
SPLASH splash10-066r-4950000000-ebfc30c0503b3948282f
Sample Comments dr = 1:1
Source of Spectrum QE-23-SM11-11-3 (DOI: 10.1002/chem.201701865)
Wiley ID 1905562