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4,15-BIS-[(1E,3E)-4-(METHOXYCARBONYL)-BUTA-1,3-DIENYL-[2.2]-PARACYCLOPHANE
SpectraBase Compound ID 6XzmNYolcf5
InChI InChI=1S/C28H28O4/c1-31-27(29)9-5-3-7-25-19-21-11-12-22-14-16-24(18-17-23(25)15-13-21)26(20-22)8-4-6-10-28(30)32-2/h3-10,13-16,19-20H,11-12,17-18H2,1-2H3/b7-3+,8-4+,9-5+,10-6+
InChIKey UELZPDOZSFGMQN-JMFUVXGRSA-N
Mol Weight 428.53 g/mol
Molecular Formula C28H28O4
Exact Mass 428.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A7WvS0OpBe9
Name 4,15-bis[4'-(Methoxycarbonyl)buta-1',3'-dienyl]-[2.2]paracyclophane
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Formula C28H28O4
InChI InChI=1S/C28H28O4/c1-31-27(29)9-5-3-7-25-19-21-11-12-22-14-16-24(18-17-23(25)15-13-21)26(20-22)8-4-6-10-28(30)32-2/h3-10,13-16,19-20H,11-12,17-18H2,1-2H3/b7-3+,8-4+,9-5+,10-6+
InChIKey UELZPDOZSFGMQN-JMFUVXGRSA-N
Molecular Weight 428.528 g/mol
SMILES c1(c2CCc3c(\C=C\C=C\C(=O)OC)cc(CCc(c1)cc2)cc3)\C=C\C=C\C(=O)OC
SPLASH splash10-08ir-0943400000-357c904c3cd14bef483b
Source of Spectrum H-2005-579-8
Synonyms Methyl (2E,4E)-5-[12-[(1E,3E)-5-methoxy-5-oxo-1,3-pentadienyl]tricyclo[8.2.2.2(4,7)]hexadeca-1(12),4,6,10,13,15-hexaen-5-yl]-2,4-pentadienoate
Wiley ID 1562230