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3,4-Heptadien-2-one, 6-hydroxy-6-methyl-5-(1-methylethyl)-
SpectraBase Compound ID K7OInpwj1Jq
InChI InChI=1S/C11H18O2/c1-8(2)10(11(4,5)13)7-6-9(3)12/h6,8,13H,1-5H3
InChIKey PISHFRQKTBUQPX-UHFFFAOYSA-N
Mol Weight 182.26 g/mol
Molecular Formula C11H18O2
Exact Mass 182.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GMUFS8ysUgS
Name 3,4-Heptadien-2-one, 6-hydroxy-6-methyl-5-(1-methylethyl)-
CAS Registry Number 60845-46-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H18O2
InChI InChI=1S/C11H18O2/c1-8(2)10(11(4,5)13)7-6-9(3)12/h6,8,13H,1-5H3
InChIKey PISHFRQKTBUQPX-UHFFFAOYSA-N
Molecular Weight 182.263 g/mol
SMILES OC(C(=C=CC(=O)C)C(C)C)(C)C
SPLASH splash10-052f-9600000000-2de604e2f71469ba165b
Source of Spectrum H-59-1270-14
Synonyms 6-Hydroxy-5-isopropyl-6-methyl-hepta-3,4-dien-2-one 6-Hydroxy-6-methyl-5-propan-2-yl-2-hepta-3,4-dienone 6-Hydroxy-6-methyl-5-propan-2-ylhepta-3,4-dien-2-one
Wiley ID 1178648