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5,6-Diphenyl-1,4-dipropyl-bicyclo[2.2.2]octa-5,7-diene-2,3-dione
SpectraBase Compound ID E3l36Ry6AXR
InChI InChI=1S/C26H26O2/c1-3-15-25-17-18-26(16-4-2,24(28)23(25)27)22(20-13-9-6-10-14-20)21(25)19-11-7-5-8-12-19/h5-14,17-18H,3-4,15-16H2,1-2H3
InChIKey QRFRFWLJXGOCAW-UHFFFAOYSA-N
Mol Weight 370.49 g/mol
Molecular Formula C26H26O2
Exact Mass 370.19328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CjMSPRF1QfG
Name 5,6-Diphenyl-1,4-dipropyl-bicyclo[2.2.2]octa-5,7-diene-2,3-dione
Alternate Name(s) 5,6-Diphenyl-1,4-dipropyl-bicyclo[2.2.2]octa-5,7-diene-2,3-quinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H26O2
InChI InChI=1S/C26H26O2/c1-3-15-25-17-18-26(16-4-2,24(28)23(25)27)22(20-13-9-6-10-14-20)21(25)19-11-7-5-8-12-19/h5-14,17-18H,3-4,15-16H2,1-2H3
InChIKey QRFRFWLJXGOCAW-UHFFFAOYSA-N
Molecular Weight 370.492 g/mol
SMILES C12(C(=C(c3ccccc3)C(C=C1)(CCC)C(C2=O)=O)c1ccccc1)CCC
SPLASH splash10-03di-0049000000-6d3229cf7fc0d0c891f6
Source of Spectrum QA-30-75-6
Wiley ID 860858