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1-Butyn-3-one, 1-(6,6-dimethyl-1,2-epoxycyclohexyl)-
SpectraBase Compound ID 7SqrJRCofqR
InChI InChI=1S/C12H16O2/c1-9(13)6-8-12-10(14-12)5-4-7-11(12,2)3/h10H,4-5,7H2,1-3H3
InChIKey ITPNMZLJZQEEOU-UHFFFAOYSA-N
Mol Weight 192.26 g/mol
Molecular Formula C12H16O2
Exact Mass 192.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BSPStEcBlnp
Name 1-Butyn-3-one, 1-(6,6-dimethyl-1,2-epoxycyclohexyl)-
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O2
InChI InChI=1S/C12H16O2/c1-9(13)6-8-12-10(14-12)5-4-7-11(12,2)3/h10H,4-5,7H2,1-3H3
InChIKey ITPNMZLJZQEEOU-UHFFFAOYSA-N
Molecular Weight 192.258 g/mol
SMILES C1CCC(C)(C)C2(C1O2)C#CC(=O)C
SPLASH splash10-0006-9700000000-ca9d3178d7caa2aee7ad
Synonyms 4-(2,2-Dimethyl-7-oxabicyclo[4.1.0]hept-1-yl)-3-butyn-2-one 4-(5,5-dimethyl-7-oxabicyclo[4.1.0]heptan-6-yl)-3-butyn-2-one 4-(5,5-dimethyl-7-oxabicyclo[4.1.0]heptan-6-yl)but-3-yn-2-one
Wiley ID 1478266