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3-Benzodioxole-5-(2,4,8-triene-methyl nonaoate)
SpectraBase Compound ID HT9VNM1TMRF
InChI InChI=1S/C17H18O4/c1-19-17(18)9-7-5-3-2-4-6-8-14-10-11-15-16(12-14)21-13-20-15/h3,5-12H,2,4,13H2,1H3/b5-3+,8-6+,9-7+
InChIKey HLJZJOPIVFTQNX-NFGBADIGSA-N
Mol Weight 286.33 g/mol
Molecular Formula C17H18O4
Exact Mass 286.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HB31wDN5DDp
Name 3-Benzodioxole-5-(2,4,8-triene-methyl nonaoate)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18O4
InChI InChI=1S/C17H18O4/c1-19-17(18)9-7-5-3-2-4-6-8-14-10-11-15-16(12-14)21-13-20-15/h3,5-12H,2,4,13H2,1H3/b5-3+,8-6+,9-7+
InChIKey HLJZJOPIVFTQNX-NFGBADIGSA-N
Molecular Weight 286.327 g/mol
SMILES c1c(\C=C\CC\C=C\C=C\C(OC)=O)ccc2c1OCO2
SPLASH splash10-0gx0-0900000000-4f596bb61bbf5e6e0f54
Source of Spectrum Y1-39B-948-1
Synonyms (2E,4E,8E)-methyl 9-(benzo[d][1,3]dioxol-5-yl)nona-2,4,8-trienoate Methyl (2E,4E,8E)-9-(1,3-benzodioxol-5-yl)nona-2,4,8-trienoate
Wiley ID 1744005