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3-Hydroxy-2,4,4-trimethyl-3-[(1E)-3-methyl-1,3-butadienyl]cyclohexanone
SpectraBase Compound ID 2vHHsvNMuJ1
InChI InChI=1S/C14H22O2/c1-10(2)6-9-14(16)11(3)12(15)7-8-13(14,4)5/h6,9,11,16H,1,7-8H2,2-5H3/b9-6+
InChIKey XSVADKOLEZWKIA-RMKNXTFCSA-N
Mol Weight 222.33 g/mol
Molecular Formula C14H22O2
Exact Mass 222.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1uWCjTUgicu
Name 3-Hydroxy-2,4,4-trimethyl-3-[(1E)-3-methyl-1,3-butadienyl]cyclohexanone
Alternate Name(s) 2,4,4-trimethyl-3-[(1E)-3-methylbuta-1,3-dienyl]-3-oxidanyl-cyclohexan-1-one 3-Hydroxy-2,4,4-trimethyl-3-[(1E)-3-methylbuta-1,3-dienyl]-1-cyclohexanone 3-Hydroxy-2,4,4-trimethyl-3-[(1E)-3-methylbuta-1,3-dienyl]cyclohexan-1-one 3-Hydroxy-2,4,4-trimethyl-3-[(1E)-3-methylbuta-1,3-dienyl]cyclohexanone Cyclohexanone, 3-hydroxy-2,4,4-trimethyl-3-(3-methyl-1,3-butadienyl)-
CAS Registry Number 88764-84-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O2
InChI InChI=1S/C14H22O2/c1-10(2)6-9-14(16)11(3)12(15)7-8-13(14,4)5/h6,9,11,16H,1,7-8H2,2-5H3/b9-6+
InChIKey XSVADKOLEZWKIA-RMKNXTFCSA-N
Molecular Weight 222.328 g/mol
SMILES OC1(C(CCC(C1C)=O)(C)C)\C=C\C(=C)C
SPLASH splash10-0532-7910000000-53b4c8295c016dd56fc4
Wiley ID 1489709