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(2E)-2-(phenylmethylene)pentanedioic acid O5-ethyl ester O1-methyl ester
SpectraBase Compound ID 6ZsA7aocsJy
InChI InChI=1S/C15H18O4/c1-3-19-14(16)10-9-13(15(17)18-2)11-12-7-5-4-6-8-12/h4-8,11H,3,9-10H2,1-2H3/b13-11+
InChIKey ZBOYDSJNONQBGL-ACCUITESSA-N
Mol Weight 262.3 g/mol
Molecular Formula C15H18O4
Exact Mass 262.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2HbZSWmDG2T
Name (2E)-2-(phenylmethylene)pentanedioic acid O5-ethyl ester O1-methyl ester
Alternate Name(s) (2E)-2-benzalglutaric acid O5-ethyl ester O1-methyl ester 5-O-ethyl 1-O-methyl (2E)-2-benzylidenepentanedioate O5-ethyl O1-methyl (2E)-2-(phenylmethylidene)pentanedioate O5-ethyl O1-methyl (2E)-2-benzylidenepentanedioate
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Formula C15H18O4
InChI InChI=1S/C15H18O4/c1-3-19-14(16)10-9-13(15(17)18-2)11-12-7-5-4-6-8-12/h4-8,11H,3,9-10H2,1-2H3/b13-11+
InChIKey ZBOYDSJNONQBGL-ACCUITESSA-N
Molecular Weight 262.305 g/mol
SMILES C(\C(=C\c1ccccc1)CCC(=O)OCC)(=O)OC
SPLASH splash10-004i-0910000000-0caa8a254882883742a4
Source of Spectrum AJ-63-474-14
Wiley ID 1265890