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2-Cyclohexen-1-one, 4-ethynyl-4-hydroxy-3,5,5-trimethyl-
SpectraBase Compound ID Lm0NHJOXWaG
InChI InChI=1S/C11H14O2/c1-5-11(13)8(2)6-9(12)7-10(11,3)4/h1,6,13H,7H2,2-4H3
InChIKey IENXNRSNFXHIOR-UHFFFAOYSA-N
Mol Weight 178.23 g/mol
Molecular Formula C11H14O2
Exact Mass 178.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BY7OaiQDsjz
Name 4-Ethynyl-4-hydroxy-3,5,5-trimethyl-2-cyclohexen-1-one
CAS Registry Number 129461-33-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H14O2
InChI InChI=1S/C11H14O2/c1-5-11(13)8(2)6-9(12)7-10(11,3)4/h1,6,13H,7H2,2-4H3
InChIKey IENXNRSNFXHIOR-UHFFFAOYSA-N
Molecular Weight 178.231 g/mol
SMILES OC1(C(CC(C=C1C)=O)(C)C)C#C
SPLASH splash10-00di-9600000000-a2bf19302719fd4e72da
Synonyms 2-Cyclohexen-1-one, 4-ethynyl-4-hydroxy-3,5,5-trimethyl- 4-Ethynyl-3,5,5-trimethyl-4-oxidanyl-cyclohex-2-en-1-one 4-Ethynyl-4-hydroxy-3,5,5-trimethyl-1-cyclohex-2-enone 4-Ethynyl-4-hydroxy-3,5,5-trimethyl-cyclohex-2-en-1-one
Wiley ID 1489395