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2-(5-hexenyloxy)-4-hydroxy-4-methyl-2-cyclobutene-1-carboxylic acid
SpectraBase Compound ID ET8Uj58tpQ1
InChI InChI=1S/C12H18O4/c1-3-4-5-6-7-16-9-8-12(2,15)10(9)11(13)14/h3,8,10,15H,1,4-7H2,2H3,(H,13,14)
InChIKey IFVLOFQFYJCWNU-UHFFFAOYSA-N
Mol Weight 226.27 g/mol
Molecular Formula C12H18O4
Exact Mass 226.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DjftEXk1rPF
Name 2-(5-hexenyloxy)-4-hydroxy-4-methyl-2-cyclobutene-1-carboxylic acid
Alternate Name(s) 2-hex-5-enoxy-4-hydroxy-4-methyl-1-cyclobut-2-enecarboxylic acid 2-hex-5-enoxy-4-hydroxy-4-methyl-cyclobut-2-ene-1-carboxylic acid 2-hex-5-enoxy-4-methyl-4-oxidanyl-cyclobut-2-ene-1-carboxylic acid
Comments Less than 3 mono-isotopic peaks
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Formula C12H18O4
InChI InChI=1S/C12H18O4/c1-3-4-5-6-7-16-9-8-12(2,15)10(9)11(13)14/h3,8,10,15H,1,4-7H2,2H3,(H,13,14)
InChIKey IFVLOFQFYJCWNU-UHFFFAOYSA-N
Molecular Weight 226.272 g/mol
SMILES OC(C1C(=CC1(O)C)OCCCCC=C)=O
SPLASH splash10-004i-0900000000-ae18d36bed7d23622760
Source of Spectrum Y-28-747-4
Wiley ID 1227341