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1-Oxo-3-(3'-hydroxy-3'-methylpent-1'-en-4'-ynyl)-5,5-dimethylcyclohex-2-ene
SpectraBase Compound ID 3GkDvSmyF88
InChI InChI=1S/C14H18O2/c1-5-14(4,16)7-6-11-8-12(15)10-13(2,3)9-11/h1,6-8,16H,9-10H2,2-4H3/b7-6+
InChIKey JWJUZEJZBWUCLH-VOTSOKGWSA-N
Mol Weight 218.3 g/mol
Molecular Formula C14H18O2
Exact Mass 218.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5fbrlYPxOGO
Name 1-Oxo-3-(3'-hydroxy-3'-methylpent-1'-en-4'-ynyl)-5,5-dimethylcyclohex-2-ene
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O2
InChI InChI=1S/C14H18O2/c1-5-14(4,16)7-6-11-8-12(15)10-13(2,3)9-11/h1,6-8,16H,9-10H2,2-4H3/b7-6+
InChIKey JWJUZEJZBWUCLH-VOTSOKGWSA-N
Molecular Weight 218.296 g/mol
SMILES OC(C#C)(\C=C\C1=CC(=O)CC(C1)(C)C)C
SPLASH splash10-00ou-4920000000-70df0b3d6341768cc9fa
Source of Spectrum U-1997-1891-21
Synonyms 3-[(1E)-3-hydroxy-3-methyl-1-penten-4-ynyl]-5,5-dimethyl-2-cyclohexen-1-one 3-[(E)-3-hydroxy-3-methylpent-1-en-4-ynyl]-5,5-dimethyl-1-cyclohex-2-enone 3-[(E)-3-hydroxy-3-methylpent-1-en-4-ynyl]-5,5-dimethylcyclohex-2-en-1-one 5,5-Dimethyl-3-[(E)-3-methyl-3-oxidanyl-pent-1-en-4-ynyl]cyclohex-2-en-1-one
Wiley ID 770025