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2-Butyl-3-(E-2'-methoxycarbonylethenyl)-5-methylfuran
SpectraBase Compound ID 3gWsHj1EVNZ
InChI InChI=1S/C13H18O3/c1-4-5-6-12-11(9-10(2)16-12)7-8-13(14)15-3/h7-9H,4-6H2,1-3H3/b8-7+
InChIKey GKLRGTWMTDWVPW-BQYQJAHWSA-N
Mol Weight 222.28 g/mol
Molecular Formula C13H18O3
Exact Mass 222.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FjGZXVsqd22
Name 2-Butyl-3-(E-2'-methoxycarbonylethenyl)-5-methylfuran
Comments Less than 3 mono-isotopic peaks
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Formula C13H18O3
InChI InChI=1S/C13H18O3/c1-4-5-6-12-11(9-10(2)16-12)7-8-13(14)15-3/h7-9H,4-6H2,1-3H3/b8-7+
InChIKey GKLRGTWMTDWVPW-BQYQJAHWSA-N
Molecular Weight 222.284 g/mol
SMILES c1(c(oc(c1)C)CCCC)\C=C\C(=O)OC
SPLASH splash10-00b9-0980000000-e331ec67b420a16466fb
Source of Spectrum QF-9-2453-3
Synonyms methyl (2E)-3-(2-butyl-5-methyl-3-furyl)-2-propenoate
Wiley ID 1558429