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6-Hydroxy-3-(3-hydroxy-3-methyl-4-penten-1-ynyl)-2,4,4-trimethyl-2-cyclohexen-1-one
SpectraBase Compound ID 7cQEjHDCOGJ
InChI InChI=1S/C15H20O3/c1-6-15(5,18)8-7-11-10(2)13(17)12(16)9-14(11,3)4/h6,12,16,18H,1,9H2,2-5H3
InChIKey RNLWMBFNWZCOAM-UHFFFAOYSA-N
Mol Weight 248.32 g/mol
Molecular Formula C15H20O3
Exact Mass 248.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D9kdVJi5QGG
Name 2,4,4-trimethyl-3-(3-methyl-3-oxidanyl-pent-4-en-1-ynyl)-6-oxidanyl-cyclohex-2-en-1-one
CAS Registry Number 83020-62-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H20O3
InChI InChI=1S/C15H20O3/c1-6-15(5,18)8-7-11-10(2)13(17)12(16)9-14(11,3)4/h6,12,16,18H,1,9H2,2-5H3
InChIKey RNLWMBFNWZCOAM-UHFFFAOYSA-N
Molecular Weight 248.322 g/mol
SMILES OC1C(C(=C(C#CC(C=C)(O)C)C(C1)(C)C)C)=O
SPLASH splash10-052f-9760000000-8ea0d0670c6a938a7fca
Source of Spectrum H-65-680-0
Synonyms 6-Hydroxy-3-(3-hydroxy-3-methyl-pent-4-en-1-ynyl)-2,4,4-trimethyl-cyclohex-2-en-1-one 6-Hydroxy-3-(3-hydroxy-3-methylpent-4-en-1-ynyl)-2,4,4-trimethyl-1-cyclohex-2-enone
Wiley ID 1251261