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1-Bromo-3,7-dimethylocta-1,5-dien-3,4,7-triol 4-acetate
SpectraBase Compound ID DT5QZ1TF3PQ
InChI InChI=1S/C12H19BrO4/c1-9(14)17-10(5-6-11(2,3)15)12(4,16)7-8-13/h5-8,10,15-16H,1-4H3/b6-5+,8-7+
InChIKey CTLKSCLQXVGMCF-BSWSSELBSA-N
Mol Weight 307.18 g/mol
Molecular Formula C12H19BrO4
Exact Mass 306.046672 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IoSStRAqyoL
Name 1-Bromo-3,7-dimethylocta-1,5-dien-3,4,7-triol 4-acetate
Alternate Name(s) (2E)-1-[(2E)-3-bromo-1-hydroxy-1-methyl-2-propenyl]-4-hydroxy-4-methyl-2-pentenyl acetate
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Formula C12H19BrO4
InChI InChI=1S/C12H19BrO4/c1-9(14)17-10(5-6-11(2,3)15)12(4,16)7-8-13/h5-8,10,15-16H,1-4H3/b6-5+,8-7+
InChIKey CTLKSCLQXVGMCF-BSWSSELBSA-N
Molecular Weight 307.184 g/mol
SMILES OC(C(\C=C\C(O)(C)C)OC(=O)C)(\C=C\Br)C
SPLASH splash10-0002-7901000000-021c425f8d40b5595c00
Source of Spectrum F-54-3579-1
Wiley ID 806424