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3,7,7-Trimethyl-1-(3-oxo-but-1-enyl)-2-oxa-bicyclo[3.2.0]hept-3-en-6-one
SpectraBase Compound ID DYkQ5kHzuXl
InChI InChI=1S/C13H16O3/c1-8(14)5-6-13-10(7-9(2)16-13)11(15)12(13,3)4/h5-7,10H,1-4H3/b6-5+
InChIKey DUEYOOZUZMHLPS-AATRIKPKSA-N
Mol Weight 220.27 g/mol
Molecular Formula C13H16O3
Exact Mass 220.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 72DdKGYXKpi
Name 3,7,7-Trimethyl-1-(3-oxo-but-1-enyl)-2-oxa-bicyclo[3.2.0]hept-3-en-6-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O3
InChI InChI=1S/C13H16O3/c1-8(14)5-6-13-10(7-9(2)16-13)11(15)12(13,3)4/h5-7,10H,1-4H3/b6-5+
InChIKey DUEYOOZUZMHLPS-AATRIKPKSA-N
Molecular Weight 220.268 g/mol
SMILES C12(C(C=C(O2)C)C(C1(C)C)=O)\C=C\C(=O)C
SPLASH splash10-002u-8900000000-8412bba2be092aeeb314
Synonyms 3,6,6-trimethyl-5-[(E)-3-oxobut-1-enyl]-4-oxabicyclo[3.2.0]hept-2-en-7-one 3,6,6-trimethyl-5-[(E)-3-oxidanylidenebut-1-enyl]-4-oxabicyclo[3.2.0]hept-2-en-7-one 3,7,7-Trimethyl-1-[(1E)-3-oxo-1-butenyl]-2-oxabicyclo[3.2.0]hept-3-en-6-one 5-[(E)-3-ketobut-1-enyl]-3,6,6-trimethyl-4-oxabicyclo[3.2.0]hept-2-en-7-one
Wiley ID 1485990