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1-Hexanone, 1-(2,4-dihydroxy-3,5-dimethylphenyl)-
SpectraBase Compound ID 7KPb1bMtwV8
InChI InChI=1S/C14H20O3/c1-4-5-6-7-12(15)11-8-9(2)13(16)10(3)14(11)17/h8,16-17H,4-7H2,1-3H3
InChIKey QZIIIFXEYRSFCG-UHFFFAOYSA-N
Mol Weight 236.31 g/mol
Molecular Formula C14H20O3
Exact Mass 236.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3HVJNOFPIS6
Name 1-Hexanone, 1-(2,4-dihydroxy-3,5-dimethylphenyl)-
Alternate Name(s) 1-(2,4-dihydroxy-3,5-dimethylphenyl)-1-hexanone 1-(2,4-dihydroxy-3,5-dimethylphenyl)hexan-1-one 1-[3,5-dimethyl-2,4-bis(oxidanyl)phenyl]hexan-1-one
CAS Registry Number 88924-67-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20O3
InChI InChI=1S/C14H20O3/c1-4-5-6-7-12(15)11-8-9(2)13(16)10(3)14(11)17/h8,16-17H,4-7H2,1-3H3
InChIKey QZIIIFXEYRSFCG-UHFFFAOYSA-N
Molecular Weight 236.311 g/mol
SMILES Oc1c(c(c(cc1C)C(=O)CCCCC)O)C
SPLASH splash10-014i-0910000000-d50d02d1382e654939af
Source of Spectrum F-39-4254-0
Wiley ID 1238326