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1,2,4-Metheno-1H-cyclobuta[cd]pentalene-3,5-dicarboxylic acid, octahydro-3,5-dimethyl-, ethyl ester, (1.alpha.,1a.beta.,2.alpha.,3.alpha.,3a.beta.,4.alpha.,5.beta.,5a.beta.,5b.beta.)-
SpectraBase Compound ID EJJDpRQeBk5
InChI InChI=1S/C18H24O4/c1-5-21-15(19)17(3)11-7-8-9(11)14-13(17)10(7)12(8)18(14,4)16(20)22-6-2/h7-14H,5-6H2,1-4H3/t7?,8?,9-,10-,11+,12+,13-,14-,17-,18+/m1/s1
InChIKey FLGXWXYTPKPMQZ-XHCPFVEBSA-N
Mol Weight 304.39 g/mol
Molecular Formula C18H24O4
Exact Mass 304.167459 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FmYimwboKZR
Name 1,2,4-Metheno-1H-cyclobuta[cd]pentalene-3,5-dicarboxylic acid, octahydro-3,5-dimethyl-, ethyl ester, (1.alpha.,1a.beta.,2.alpha.,3.alpha.,3a.beta.,4.alpha.,5.beta.,5a.beta.,5b.beta.)-
CAS Registry Number 110677-90-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H24O4
InChI InChI=1S/C18H24O4/c1-5-21-15(19)17(3)11-7-8-9(11)14-13(17)10(7)12(8)18(14,4)16(20)22-6-2/h7-14H,5-6H2,1-4H3/t7?,8?,9-,10-,11+,12+,13-,14-,17-,18+/m1/s1
InChIKey FLGXWXYTPKPMQZ-XHCPFVEBSA-N
Molecular Weight 304.386 g/mol
SMILES [C@]1([C@]2([C@@]3([C@](C(=O)OCC)(C)[C@@]4([C@]2(C2C4[C@@]3([C@@]12[H])[H])[H])[H])[H])[H])(C(=O)OCC)C
SPLASH splash10-0f89-5920000000-5e74b9020f84e52702e7
Source of Spectrum H-70-591-11
Synonyms Diethyl 6,10-Dimethylpentacyclo[5.3.0.0(2,5).0(3,9).0(4,8)]decane-6,10-dicarboxylate
Wiley ID 1306569