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2'-hydroxy-5'-isopropyl-4'-methylheptanophenone
SpectraBase Compound ID 6AF0UCOWJM4
InChI InChI=1S/C17H26O2/c1-5-6-7-8-9-16(18)15-11-14(12(2)3)13(4)10-17(15)19/h10-12,19H,5-9H2,1-4H3
InChIKey IHVYSKKRDQOEAA-UHFFFAOYSA-N
Mol Weight 262.39 g/mol
Molecular Formula C17H26O2
Exact Mass 262.19328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fu9rfuzhQJE
Name 1-Heptanone, 1-[2-hydroxy-4-methyl-5-(1-methylethyl)phenyl]-
Alternate Name(s) 1-(2-hydroxy-5-isopropyl-4-methylphenyl)-1-heptanone 1-[2-hydroxy-4-methyl-5-(1-methylethyl)phenyl]-1-heptanone 1-(2-hydroxy-4-methyl-5-propan-2-ylphenyl)-1-heptanone 1-(2-hydroxy-4-methyl-5-propan-2-ylphenyl)heptan-1-one 1-(4-methyl-2-oxidanyl-5-propan-2-yl-phenyl)heptan-1-one
CAS Registry Number 129375-11-7
Comments Less than 3 mono-isotopic peaks
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Formula C17H26O2
InChI InChI=1S/C17H26O2/c1-5-6-7-8-9-16(18)15-11-14(12(2)3)13(4)10-17(15)19/h10-12,19H,5-9H2,1-4H3
InChIKey IHVYSKKRDQOEAA-UHFFFAOYSA-N
Molecular Weight 262.393 g/mol
SMILES Oc1c(cc(C(C)C)c(c1)C)C(=O)CCCCCC
SPLASH splash10-004i-0930000000-f28a242e2333d4c9177a
Source of Spectrum AH-121-235-26
Wiley ID 1266329