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cis-3,6-Dipropyl-cyclohexa-3,5-diene-1,2-dicarboxylic acid diethyl ester
SpectraBase Compound ID 5FcRI1LYMgd
InChI InChI=1S/C18H28O4/c1-5-9-13-11-12-14(10-6-2)16(18(20)22-8-4)15(13)17(19)21-7-3/h11-12,15-16H,5-10H2,1-4H3/t15-,16+
InChIKey RSOSUKZXVQTOOG-IYBDPMFKSA-N
Mol Weight 308.42 g/mol
Molecular Formula C18H28O4
Exact Mass 308.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1wF3DNTSVXQ
Name cis-3,6-Dipropyl-cyclohexa-3,5-diene-1,2-dicarboxylic acid diethyl ester
Alternate Name(s) cis-Diethyl 3,6-Di-n-propylhexadien-1,2-dicarboxylate Diethyl (1R,2S)-3,6-dipropyl-3,5-cyclohexadiene-1,2-dicarboxylate
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Formula C18H28O4
InChI InChI=1S/C18H28O4/c1-5-9-13-11-12-14(10-6-2)16(18(20)22-8-4)15(13)17(19)21-7-3/h11-12,15-16H,5-10H2,1-4H3/t15-,16+
InChIKey RSOSUKZXVQTOOG-IYBDPMFKSA-N
Molecular Weight 308.418 g/mol
SMILES [C@]1([C@](C(CCC)=CC=C1CCC)(C(=O)OCC)[H])(C(=O)OCC)[H]
SPLASH splash10-0fal-9211000000-8ed86b5d37147165a454
Source of Spectrum QA-31-75-5
Wiley ID 860920