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(1R,5S,7S)-5-ethyl-7-methyl-6,8-dioxabicyclo[3.2.1]octan-2-one
SpectraBase Compound ID 4C7VNQUSJ2j
InChI InChI=1S/C9H14O3/c1-3-9-5-4-7(10)8(12-9)6(2)11-9/h6,8H,3-5H2,1-2H3/t6-,8+,9-/m0/s1
InChIKey FSFYIAZJFCNAGC-ZQARSLAVSA-N
Mol Weight 170.21 g/mol
Molecular Formula C9H14O3
Exact Mass 170.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 76CaDfsIUyl
Name (1R,5S,7S)-5-ethyl-7-methyl-6,8-dioxabicyclo[3.2.1]octan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H14O3
InChI InChI=1S/C9H14O3/c1-3-9-5-4-7(10)8(12-9)6(2)11-9/h6,8H,3-5H2,1-2H3/t6-,8+,9-/m0/s1
InChIKey FSFYIAZJFCNAGC-ZQARSLAVSA-N
Molecular Weight 170.208 g/mol
SMILES [C@@]12(O[C@]([C@@](O2)(C)[H])(C(CC1)=O)[H])CC
SPLASH splash10-0597-9000000000-7d927200ccc218d54662
Source of Spectrum KC-60-1477-7
Synonyms endo-5-Ethyl-7-methyl-6,8-dioxabicyclo[3.2.1]octan-2-one
Wiley ID 1583409