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3,4,5,6-Tetraphenyl-2,7-octanedione

View entire compound with spectra: 1 MS (GC)

3,4,5,6-Tetraphenyl-2,7-octanedione
SpectraBase Compound ID jIUWxolrwu
InChI InChI=1S/C32H30O2/c1-23(33)29(25-15-7-3-8-16-25)31(27-19-11-5-12-20-27)32(28-21-13-6-14-22-28)30(24(2)34)26-17-9-4-10-18-26/h3-22,29-32H,1-2H3
InChIKey NDFKRRQNWZCWPX-UHFFFAOYSA-N
Mol Weight 446.6 g/mol
Molecular Formula C32H30O2
Exact Mass 446.22458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AmXonCwaaNQ
Name 3,4,5,6-Tetraphenyl-2,7-octanedione
CAS Registry Number 87870-45-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H30O2
InChI InChI=1S/C32H30O2/c1-23(33)29(25-15-7-3-8-16-25)31(27-19-11-5-12-20-27)32(28-21-13-6-14-22-28)30(24(2)34)26-17-9-4-10-18-26/h3-22,29-32H,1-2H3
InChIKey NDFKRRQNWZCWPX-UHFFFAOYSA-N
Molecular Weight 446.590 g/mol
SMILES C(C(C(C(=O)C)c1ccccc1)c1ccccc1)(C(C(=O)C)c1ccccc1)c1ccccc1
SPLASH splash10-001i-0923000000-0964803ed65cbb8b71ce
Source of Spectrum J-49-28-3
Wiley ID 1386855