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(E)-4-(4-Bromobut-2-enyloxy)-3-(2-methylbut-3-en-2-yloxy)-9H-xanthen-9-one
SpectraBase Compound ID FSRv9YIQUIg
InChI InChI=1S/C22H21BrO4/c1-4-22(2,3)27-18-12-11-16-19(24)15-9-5-6-10-17(15)26-20(16)21(18)25-14-8-7-13-23/h4-12H,1,13-14H2,2-3H3/b8-7+
InChIKey SQLOGOZVBCWOMT-BQYQJAHWSA-N
Mol Weight 429.31 g/mol
Molecular Formula C22H21BrO4
Exact Mass 428.062322 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BdbZ08lysVF
Name (E)-4-(4-Bromobut-2-enyloxy)-3-(2-methylbut-3-en-2-yloxy)-9H-xanthen-9-one
Appearance Yellow solid
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Formula C22H21BrO4
InChI InChI=1S/C22H21BrO4/c1-4-22(2,3)27-18-12-11-16-19(24)15-9-5-6-10-17(15)26-20(16)21(18)25-14-8-7-13-23/h4-12H,1,13-14H2,2-3H3/b8-7+
InChIKey SQLOGOZVBCWOMT-BQYQJAHWSA-N
Instrument Name Shimadzu GCMS-2010
Ionization Type EI
Literature Reference DOI 10.1021/jm301593r
Molecular Weight 429.310 g/mol
SMILES c1(OC\C=C\CBr)c2c(ccc1OC(C=C)(C)C)C(c1c(cccc1)O2)=O
SPLASH splash10-014i-9030100000-c7308b4e120e7bcdbc93
Source of Spectrum AF-56-SM10-44
Wiley ID 1854453