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2-Buten-1-one, 1-(2,2,5a-trimethylperhydro-1-benzoxiren-1-yl)
SpectraBase Compound ID KLm54a41aBF
InChI InChI=1S/C13H20O2/c1-5-7-10(14)13-11(2,3)8-6-9-12(13,4)15-13/h5,7H,6,8-9H2,1-4H3/b7-5+
InChIKey BUWPDGJCRXZXGG-FNORWQNLSA-N
Mol Weight 208.3 g/mol
Molecular Formula C13H20O2
Exact Mass 208.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ji1GkwxtzUL
Name 2-Buten-1-one, 1-(2,2,5a-trimethylperhydro-1-benzoxiren-1-yl)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O2
InChI InChI=1S/C13H20O2/c1-5-7-10(14)13-11(2,3)8-6-9-12(13,4)15-13/h5,7H,6,8-9H2,1-4H3/b7-5+
InChIKey BUWPDGJCRXZXGG-FNORWQNLSA-N
Molecular Weight 208.301 g/mol
SMILES C1CC(C2(C(C1)(O2)C)C(=O)\C=C\C)(C)C
SPLASH splash10-014i-9300000000-487a4dc33debeab3ce7e
Synonyms (2E)-1-(2,2,6-Trimethyl-7-oxabicyclo[4.1.0]hept-1-yl)-2-buten-1-one (E)-1-(1,5,5-trimethyl-7-oxabicyclo[4.1.0]heptan-6-yl)-2-buten-1-one (E)-1-(1,5,5-trimethyl-7-oxabicyclo[4.1.0]heptan-6-yl)but-2-en-1-one
Wiley ID 1478460