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1,3-DIOXAN-4-ONE-5-D, 2-(1,1-DIMETHYLETHYL)-6-METHYL-, [2R-(2alpha,5alpha,6alpha)]-
SpectraBase Compound ID J0bQPzY5Xr5
InChI InChI=1S/C9H16O3/c1-6-5-7(10)12-8(11-6)9(2,3)4/h6,8H,5H2,1-4H3
InChIKey SFWUTHYTQUXJTB-UHFFFAOYSA-N
Mol Weight 172.22 g/mol
Molecular Formula C9H16O3
Exact Mass 172.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LFgotbZqo0P
Name 2-tert-Butyl-6-methyl-1,3-dioxan-4-one
Alternate Name(s) 1,3-Dioxan-4-one, 2-(1,1-dimethylethyl)-6-methyl-
CAS Registry Number 113505-75-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H16O3
InChI InChI=1S/C9H16O3/c1-6-5-7(10)12-8(11-6)9(2,3)4/h6,8H,5H2,1-4H3
InChIKey SFWUTHYTQUXJTB-UHFFFAOYSA-N
Molecular Weight 172.224 g/mol
SMILES CC(C1OC(CC(O1)C)=O)(C)C
SPLASH splash10-05mx-9000000000-bd0955e27b819613eb57
Wiley ID 1490050