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[(1S,2S,5R)-4-oxidanylidene-3-oxabicyclo[3.2.0]heptan-2-yl]methyl ethanoate
SpectraBase Compound ID C71ijJfUrOd
InChI InChI=1S/C9H12O4/c1-5(10)12-4-8-6-2-3-7(6)9(11)13-8/h6-8H,2-4H2,1H3/t6-,7+,8+/m0/s1
InChIKey FRCGNPUIYSJYPT-XLPZGREQSA-N
Mol Weight 184.19 g/mol
Molecular Formula C9H12O4
Exact Mass 184.073559 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6Iv8cKcfhWI
Name [(1S,2S,5R)-4-oxidanylidene-3-oxabicyclo[3.2.0]heptan-2-yl]methyl ethanoate
Alternate Name(s) [(1S,2S,5R)-4-oxo-3-oxabicyclo[3.2.0]heptan-2-yl]methyl acetate Acetic acid [(1S,2S,5R)-4-oxo-3-oxabicyclo[3.2.0]heptan-2-yl]methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O4
InChI InChI=1S/C9H12O4/c1-5(10)12-4-8-6-2-3-7(6)9(11)13-8/h6-8H,2-4H2,1H3/t6-,7+,8+/m0/s1
InChIKey FRCGNPUIYSJYPT-XLPZGREQSA-N
Molecular Weight 184.191 g/mol
SMILES C1(O[C@](COC(=O)C)([C@@]2([C@]1(CC2)[H])[H])[H])=O
SPLASH splash10-03ec-9600000000-3235b90eb1deab6dd7e9
Source of Spectrum QC-2-1400-12
Wiley ID 882996