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2-[(1E,5E)-6-(2,2-dicarbethoxycyclopentyl)-3,4-dimethyl-hexa-1,5-dienyl]cyclopentane-1,1-dicarboxylic acid diethyl ester
SpectraBase Compound ID 8k6BaxBre58
InChI InChI=1S/C30H46O8/c1-7-35-25(31)29(26(32)36-8-2)19-11-13-23(29)17-15-21(5)22(6)16-18-24-14-12-20-30(24,27(33)37-9-3)28(34)38-10-4/h15-18,21-24H,7-14,19-20H2,1-6H3/b17-15+,18-16+
InChIKey WZEJPQXGRBZNHE-YTEMWHBBSA-N
Mol Weight 534.7 g/mol
Molecular Formula C30H46O8
Exact Mass 534.319268 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GIsW5MtctvB
Name 2-[(1E,5E)-6-(2,2-dicarbethoxycyclopentyl)-3,4-dimethyl-hexa-1,5-dienyl]cyclopentane-1,1-dicarboxylic acid diethyl ester
Alternate Name(s) 2-[(1E,5E)-6-[2,2-bis(ethoxycarbonyl)cyclopentyl]-3,4-dimethylhexa-1,5-dienyl]cyclopentane-1,1-dicarboxylic acid diethyl ester Diethyl 2-[(1E,5E)-6-[2,2-bis(ethoxycarbonyl)cyclopentyl]-3,4-dimethyl-hexa-1,5-dienyl]cyclopentane-1,1-dicarboxylate
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Formula C30H46O8
InChI InChI=1S/C30H46O8/c1-7-35-25(31)29(26(32)36-8-2)19-11-13-23(29)17-15-21(5)22(6)16-18-24-14-12-20-30(24,27(33)37-9-3)28(34)38-10-4/h15-18,21-24H,7-14,19-20H2,1-6H3/b17-15+,18-16+
InChIKey WZEJPQXGRBZNHE-YTEMWHBBSA-N
Molecular Weight 534.690 g/mol
SMILES C1(C(=O)OCC)(C(=O)OCC)C(\C=C\C(C(\C=C\C2C(C(=O)OCC)(C(=O)OCC)CCC2)C)C)CCC1
SPLASH splash10-014l-1930000000-96d1f4fcc008ee1f8673
Source of Spectrum K1-2002-726-3
Wiley ID 1522128