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4,4'-DIOXO-4,4'-[NONAN-1,9-DIYLDI-(PARA-PHENYLENE)]-DIBUTANOATE
SpectraBase Compound ID 6XKTA7WQogw
InChI InChI=1S/C31H40O6/c1-36-30(34)22-20-28(32)26-16-12-24(13-17-26)10-8-6-4-3-5-7-9-11-25-14-18-27(19-15-25)29(33)21-23-31(35)37-2/h12-19H,3-11,20-23H2,1-2H3
InChIKey WZPIWYKNZBGSKE-UHFFFAOYSA-N
Mol Weight 508.7 g/mol
Molecular Formula C31H40O6
Exact Mass 508.282489 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6EkSmFFI8K5
Name 4-keto-4-[4-[9-[4-(4-keto-4-methoxy-butanoyl)phenyl]nonyl]phenyl]butyric acid methyl ester
Alternate Name(s) 4-[4-[9-[4-(4-methoxy-1,4-dioxobutyl)phenyl]nonyl]phenyl]-4-oxobutanoic acid methyl ester Methyl 4-[4-[9-[4-(4-methoxy-4-oxidanylidene-butanoyl)phenyl]nonyl]phenyl]-4-oxidanylidene-butanoate Methyl 4-[4-[9-[4-(4-methoxy-4-oxo-butanoyl)phenyl]nonyl]phenyl]-4-oxo-butanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H40O6
InChI InChI=1S/C31H40O6/c1-36-30(34)22-20-28(32)26-16-12-24(13-17-26)10-8-6-4-3-5-7-9-11-25-14-18-27(19-15-25)29(33)21-23-31(35)37-2/h12-19H,3-11,20-23H2,1-2H3
InChIKey WZPIWYKNZBGSKE-UHFFFAOYSA-N
Molecular Weight 508.655 g/mol
SMILES C(c1ccc(cc1)CCCCCCCCCc1ccc(C(=O)CCC(=O)OC)cc1)(=O)CCC(=O)OC
SPLASH splash10-014r-0906500000-acee3ee6f16e411dad5a
Source of Spectrum KC-0-1147-29
Wiley ID 785650