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6-(3',4'-Methylenedioxyphenyl)-E-5-hexenoic acid propylene glycol ester
SpectraBase Compound ID 6wqfobU3qYA
InChI InChI=1S/C16H20O5/c17-9-4-10-19-16(18)6-3-1-2-5-13-7-8-14-15(11-13)21-12-20-14/h2,5,7-8,11,17H,1,3-4,6,9-10,12H2/b5-2+
InChIKey NKRQJFQOEAMUEA-GORDUTHDSA-N
Mol Weight 292.33 g/mol
Molecular Formula C16H20O5
Exact Mass 292.131074 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B1bFmr9p10a
Name 6-(3',4'-Methylenedioxyphenyl)-E-5-hexenoic acid propylene glycol ester
Alternate Name(s) 3-Hydroxypropyl (5E)-6-(1,3-benzodioxol-5-yl)-5-hexenoate (E)-6-(1,3-benzodioxol-5-yl)-5-hexenoic acid 3-hydroxypropyl ester 3-Hydroxypropyl (E)-6-(1,3-benzodioxol-5-yl)hex-5-enoate 3-Oxidanylpropyl (E)-6-(1,3-benzodioxol-5-yl)hex-5-enoate
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Formula C16H20O5
InChI InChI=1S/C16H20O5/c17-9-4-10-19-16(18)6-3-1-2-5-13-7-8-14-15(11-13)21-12-20-14/h2,5,7-8,11,17H,1,3-4,6,9-10,12H2/b5-2+
InChIKey NKRQJFQOEAMUEA-GORDUTHDSA-N
Molecular Weight 292.331 g/mol
SMILES OCCCOC(CCC\C=C\c1cc2c(OCO2)cc1)=O
SPLASH splash10-00dl-0970000000-20562a4726b22cfde566
Source of Spectrum F-50-11120-9
Wiley ID 789548