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Pallidisetin B - 6'-acetate

View entire compound with spectra: 2 MS (GC)

Pallidisetin B - 6'-acetate
SpectraBase Compound ID HWKKe086vX9
InChI InChI=1S/C25H20O4/c1-17(26)28-20-14-21(23(27)13-12-18-8-4-2-5-9-18)22-16-24(29-25(22)15-20)19-10-6-3-7-11-19/h2-15,24H,16H2,1H3/b13-12+
InChIKey YLHVNLRGQNCYJP-OUKQBFOZSA-N
Mol Weight 384.43 g/mol
Molecular Formula C25H20O4
Exact Mass 384.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B2JEXp36rYG
Name Pallidisetin B - 6'-acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H20O4
InChI InChI=1S/C25H20O4/c1-17(26)28-20-14-21(23(27)13-12-18-8-4-2-5-9-18)22-16-24(29-25(22)15-20)19-10-6-3-7-11-19/h2-15,24H,16H2,1H3/b13-12+
InChIKey YLHVNLRGQNCYJP-OUKQBFOZSA-N
Molecular Weight 384.431 g/mol
SMILES c12c(OC(C2)c2ccccc2)cc(cc1C(\C=C\c1ccccc1)=O)OC(=O)C
SPLASH splash10-01qi-0196000000-62ea3a9d455797d7abba
Source of Spectrum X2-57-41-9
Synonyms Pallidisetin A - 6'-acetate
Wiley ID 1605308