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2,4,6-tris(5-bromanylpentyl)-1,3,5-trioxane

View entire compound with spectra: 1 MS (GC)

2,4,6-tris(5-bromanylpentyl)-1,3,5-trioxane
SpectraBase Compound ID LlGXf8FfEJx
InChI InChI=1S/C18H33Br3O3/c19-13-7-1-4-10-16-22-17(11-5-2-8-14-20)24-18(23-16)12-6-3-9-15-21/h16-18H,1-15H2
InChIKey WLQHAVCTPQCWSZ-UHFFFAOYSA-N
Mol Weight 537.2 g/mol
Molecular Formula C18H33Br3O3
Exact Mass 533.997984 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID fQWWPK4roY
Name 2,4,6-tris(5-bromanylpentyl)-1,3,5-trioxane
Alternate Name(s) 2,4,6-tris(5-bromopentyl)-1,3,5-trioxane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H33Br3O3
InChI InChI=1S/C18H33Br3O3/c19-13-7-1-4-10-16-22-17(11-5-2-8-14-20)24-18(23-16)12-6-3-9-15-21/h16-18H,1-15H2
InChIKey WLQHAVCTPQCWSZ-UHFFFAOYSA-N
Molecular Weight 537.171 g/mol
SMILES C1(OC(OC(O1)CCCCCBr)CCCCCBr)CCCCCBr
SPLASH splash10-014i-9203000000-b7af0d0578b9944b1fda
Source of Spectrum KC-57-6186-16
Wiley ID 1625126