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2-(6-phenylhex-5-ynylidene)malonic acid diethyl ester
SpectraBase Compound ID oiaGVMzHDF
InChI InChI=1S/C19H22O4/c1-3-22-18(20)17(19(21)23-4-2)15-11-6-5-8-12-16-13-9-7-10-14-16/h7,9-10,13-15H,3-6,11H2,1-2H3
InChIKey XJBAUKXVYVBGOU-UHFFFAOYSA-N
Mol Weight 314.38 g/mol
Molecular Formula C19H22O4
Exact Mass 314.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8NTcsgxZF80
Name 2-(6-phenylhex-5-ynylidene)malonic acid diethyl ester
Alternate Name(s) 2-(6-phenylhex-5-ynylidene)propanedioic acid diethyl ester Diethyl 2-(6-phenylhex-5-ynylidene)propanedioate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H22O4
InChI InChI=1S/C19H22O4/c1-3-22-18(20)17(19(21)23-4-2)15-11-6-5-8-12-16-13-9-7-10-14-16/h7,9-10,13-15H,3-6,11H2,1-2H3
InChIKey XJBAUKXVYVBGOU-UHFFFAOYSA-N
Molecular Weight 314.381 g/mol
SMILES C(=CCCCC#Cc1ccccc1)(C(=O)OCC)C(=O)OCC
SPLASH splash10-0006-0091000000-0873df1185a07252c27d
Source of Spectrum J-67-2897-2
Wiley ID 1569730