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2',4',4"-ttrimethyl-lophirone D
SpectraBase Compound ID Ak6jKMvPgMP
InChI InChI=1S/C27H22O6/c1-30-19-8-6-18(7-9-19)27-23(16-28)22-14-17(5-13-25(22)33-27)4-12-24(29)21-11-10-20(31-2)15-26(21)32-3/h4-16H,1-3H3/b12-4+
InChIKey ZOUSSVYDOBYIIB-UUILKARUSA-N
Mol Weight 442.47 g/mol
Molecular Formula C27H22O6
Exact Mass 442.141638 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DJBJBtWuRXp
Name 2',4',4"-ttrimethyl-lophirone D
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H22O6
InChI InChI=1S/C27H22O6/c1-30-19-8-6-18(7-9-19)27-23(16-28)22-14-17(5-13-25(22)33-27)4-12-24(29)21-11-10-20(31-2)15-26(21)32-3/h4-16H,1-3H3/b12-4+
InChIKey ZOUSSVYDOBYIIB-UUILKARUSA-N
Molecular Weight 442.467 g/mol
SMILES c1(c(oc2c1cc(\C=C\C(c1c(cc(cc1)OC)OC)=O)cc2)-c1ccc(cc1)OC)C=O
SPLASH splash10-014i-0910100000-4cb9e9db60c548360f31
Source of Spectrum X2-52-288-1
Wiley ID 1603059