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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 LJurN8LYfld
Name 1,3-DIOXAN-4-ONE-5-D, 2-(1,1-DIMETHYLETHYL)-6-METHYL-, [2R-(2alpha,5alpha,6alpha)]-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H15O3D
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 172.1095
SMILES C1C(=O)OC(C(C)(C)C)OC1C
SPLASH splash10-0avl-9000000000-e4664ca46fe6be37bcd4
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany