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4,5-Diacetoxy-2,7-dibromo-3,6-dimethyl-1H-indenone
SpectraBase Compound ID JSWLgZ83L60
InChI InChI=1S/C15H12Br2O5/c1-5-9-10(13(20)12(5)17)11(16)6(2)14(21-7(3)18)15(9)22-8(4)19/h1-4H3
InChIKey NLJYUKCZRKGODG-UHFFFAOYSA-N
Mol Weight 432.06 g/mol
Molecular Formula C15H12Br2O5
Exact Mass 429.905149 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G2NiPa9Qm7K
Name 4,5-Diacetoxy-2,7-dibromo-3,6-dimethyl-1H-indenone
CAS Registry Number 77028-51-4
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H12Br2O5
InChI InChI=1S/C15H12Br2O5/c1-5-9-10(13(20)12(5)17)11(16)6(2)14(21-7(3)18)15(9)22-8(4)19/h1-4H3
InChIKey NLJYUKCZRKGODG-UHFFFAOYSA-N
Molecular Weight 432.064 g/mol
SMILES c12c(C(C)=C(C2=O)Br)c(OC(=O)C)c(c(c1Br)C)OC(=O)C
SPLASH splash10-01bc-4193000000-5b55223fd9db21c43656
Source of Spectrum J-46-2391-0
Synonyms 4-(acetyloxy)-2,7-dibromo-3,6-dimethyl-1-oxo-1H-inden-5-yl acetate
Wiley ID 1381341