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2-tert-Butyl-6-methyl-5-(1-phenylbutyl)-1,3-dioxan-4-one
SpectraBase Compound ID 7KeJZU6ozwB
InChI InChI=1S/C19H28O3/c1-6-10-15(14-11-8-7-9-12-14)16-13(2)21-18(19(3,4)5)22-17(16)20/h7-9,11-13,15-16,18H,6,10H2,1-5H3
InChIKey LWYGSMALWPJAME-UHFFFAOYSA-N
Mol Weight 304.43 g/mol
Molecular Formula C19H28O3
Exact Mass 304.203845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GnV0Gjz9BFK
Name 2-tert-Butyl-6-methyl-5-(1-phenylbutyl)-1,3-dioxan-4-one
Alternate Name(s) 2-t-Butyl-6-methyl-5-(1-phenylbutyl)[1,3]dioxan-4-one
CAS Registry Number 129287-62-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H28O3
InChI InChI=1S/C19H28O3/c1-6-10-15(14-11-8-7-9-12-14)16-13(2)21-18(19(3,4)5)22-17(16)20/h7-9,11-13,15-16,18H,6,10H2,1-5H3
InChIKey LWYGSMALWPJAME-UHFFFAOYSA-N
Molecular Weight 304.430 g/mol
SMILES CC(C1OC(C(C(O1)C)C(CCC)c1ccccc1)=O)(C)C
SPLASH splash10-001l-7940000000-99870aad75235f2cd2f8
Source of Spectrum K-123-2423-26
Wiley ID 1306722