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(3S,4S,5S)-3-Butyl-4,5-epoxy-5-methyltetrahydrofuran-2-one
SpectraBase Compound ID F8rLkr6PA24
InChI InChI=1S/C9H14O3/c1-3-4-5-9-7(12-9)6(2)11-8(9)10/h6-7H,3-5H2,1-2H3/t6-,7-,9-/m0/s1
InChIKey VCJXKOYZGGXHBQ-ZKWXMUAHSA-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 CJDNVA71c
Name (3S,4S,5S)-3-Butyl-4,5-epoxy-5-methyltetrahydrofuran-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H14O3
InChI InChI=1S/C9H14O3/c1-3-4-5-9-7(12-9)6(2)11-8(9)10/h6-7H,3-5H2,1-2H3/t6-,7-,9-/m0/s1
InChIKey VCJXKOYZGGXHBQ-ZKWXMUAHSA-N
Molecular Weight 170.208 g/mol
SMILES [C@]12([C@]([C@](C)(OC2=O)[H])(O1)[H])CCCC
SPLASH splash10-0670-9000000000-3b9a2627bdb6c6114fb1
Source of Spectrum F-50-8343-10
Synonyms (1S,4S,5S)-1-Butyl-4-methyl-3,6-dioxa-bicyclo[3.1.0]hexan-2-one (1S,4S,5S)-4-butyl-1-methyl-2,6-dioxabicyclo[3.1.0]hexan-3-one
Wiley ID 1166692