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(2E)-2-(1-phenylbutylidene)butanedioic acid O1-ethyl ester O4-methyl ester
SpectraBase Compound ID 9JAzT0OUuDT
InChI InChI=1S/C17H22O4/c1-4-9-14(13-10-7-6-8-11-13)15(12-16(18)20-3)17(19)21-5-2/h6-8,10-11H,4-5,9,12H2,1-3H3/b15-14+
InChIKey XPYWCVKOWKXGOA-CCEZHUSRSA-N
Mol Weight 290.36 g/mol
Molecular Formula C17H22O4
Exact Mass 290.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FbQ0kNQOXFg
Name (2E)-2-(1-phenylbutylidene)butanedioic acid O1-ethyl ester O4-methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22O4
InChI InChI=1S/C17H22O4/c1-4-9-14(13-10-7-6-8-11-13)15(12-16(18)20-3)17(19)21-5-2/h6-8,10-11H,4-5,9,12H2,1-3H3/b15-14+
InChIKey XPYWCVKOWKXGOA-CCEZHUSRSA-N
Molecular Weight 290.359 g/mol
SMILES c1(\C(=C\(C(=O)OCC)CC(=O)OC)CCC)ccccc1
SPLASH splash10-0006-0290000000-a5acb3f3fe7c7fcad2dc
Source of Spectrum KC-0-1839-13
Synonyms (2E)-2-(1-phenylbutylidene)succinic acid O1-ethyl ester O4-methyl ester 1-O-ethyl 4-O-methyl (2E)-2-(1-phenylbutylidene)butanedioate O1-ethyl O4-methyl (2E)-2-(1-phenylbutylidene)butanedioate
Wiley ID 781553