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(6E)-7-(1,3-benzodioxol-5-yl)-6-heptenal
SpectraBase Compound ID KA6PQCOEVyI
InChI InChI=1S/C14H16O3/c15-9-5-3-1-2-4-6-12-7-8-13-14(10-12)17-11-16-13/h4,6-10H,1-3,5,11H2/b6-4+
InChIKey QKTNKKKUQIZFNO-GQCTYLIASA-N
Mol Weight 232.28 g/mol
Molecular Formula C14H16O3
Exact Mass 232.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1UizDPlAvjv
Name (6E)-7-(1,3-benzodioxol-5-yl)-6-heptenal
Alternate Name(s) (E)-7-(1,3-benzodioxol-5-yl)-6-heptenal
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16O3
InChI InChI=1S/C14H16O3/c15-9-5-3-1-2-4-6-12-7-8-13-14(10-12)17-11-16-13/h4,6-10H,1-3,5,11H2/b6-4+
InChIKey QKTNKKKUQIZFNO-GQCTYLIASA-N
Molecular Weight 232.279 g/mol
SMILES c12c(OCO2)ccc(\C=C\CCCCC=O)c1
SPLASH splash10-001i-0950000000-cc6849cde05851522ba1
Source of Spectrum F-50-11118-6
Wiley ID 789552