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2-tert-Butyl-6-methyl-6-octyl-1,3-dioxan-4-one
SpectraBase Compound ID BJ5QU933ogy
InChI InChI=1S/C17H32O3/c1-6-7-8-9-10-11-12-17(5)13-14(18)19-15(20-17)16(2,3)4/h15H,6-13H2,1-5H3
InChIKey CIKCMLKVOONUDY-UHFFFAOYSA-N
Mol Weight 284.4 g/mol
Molecular Formula C17H32O3
Exact Mass 284.235145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9aFr2DLsWBR
Name 2-tert-Butyl-6-methyl-6-octyl-1,3-dioxan-4-one
Alternate Name(s) 1,3-Dioxan-4-one, 2-(1,1-dimethylethyl)-6-methyl-6-octyl
CAS Registry Number 107289-23-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H32O3
InChI InChI=1S/C17H32O3/c1-6-7-8-9-10-11-12-17(5)13-14(18)19-15(20-17)16(2,3)4/h15H,6-13H2,1-5H3
InChIKey CIKCMLKVOONUDY-UHFFFAOYSA-N
Molecular Weight 284.440 g/mol
SMILES C1(OC(=O)CC(C)(CCCCCCCC)O1)C(C)(C)C
SPLASH splash10-0089-5910000000-0f9ca771289215f17f1c
Wiley ID 1478310