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Dimethyl 5-phenyl-2-hexenedioate
SpectraBase Compound ID 3zjOQDVPOIO
InChI InChI=1S/C14H16O4/c1-17-13(15)10-6-9-12(14(16)18-2)11-7-4-3-5-8-11/h3-8,10,12H,9H2,1-2H3/b10-6+
InChIKey VGQOCZWGSHPXPG-UXBLZVDNSA-N
Mol Weight 248.28 g/mol
Molecular Formula C14H16O4
Exact Mass 248.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BBYZW5KoXYL
Name Dimethyl 5-phenyl-2-hexenedioate
Alternate Name(s) Dimethyl (2E)-5-phenyl-2-hexenedioate
CAS Registry Number 86834-72-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16O4
InChI InChI=1S/C14H16O4/c1-17-13(15)10-6-9-12(14(16)18-2)11-7-4-3-5-8-11/h3-8,10,12H,9H2,1-2H3/b10-6+
InChIKey VGQOCZWGSHPXPG-UXBLZVDNSA-N
Molecular Weight 248.278 g/mol
SMILES C(C(c1ccccc1)C\C=C\C(=O)OC)(=O)OC
SPLASH splash10-014j-0960000000-593fe11ef699b41fe0c0
Source of Spectrum J-48-3555-0
Wiley ID 1251027