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1,3-Xylyl-15-crown-4, 2-bromo-

View entire compound with spectra: 2 MS (GC)

1,3-Xylyl-15-crown-4, 2-bromo-
SpectraBase Compound ID 6ODzgEPDb4o
InChI InChI=1S/C14H19BrO4/c15-14-12-2-1-3-13(14)11-19-9-7-17-5-4-16-6-8-18-10-12/h1-3H,4-11H2
InChIKey XDMWUNRJDHEEAN-UHFFFAOYSA-N
Mol Weight 331.21 g/mol
Molecular Formula C14H19BrO4
Exact Mass 330.046672 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KWnZot48lhR
Name 1,3-Xylyl-15-crown-4, 2-bromo-
CAS Registry Number 111982-21-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H19BrO4
InChI InChI=1S/C14H19BrO4/c15-14-12-2-1-3-13(14)11-19-9-7-17-5-4-16-6-8-18-10-12/h1-3H,4-11H2
InChIKey XDMWUNRJDHEEAN-UHFFFAOYSA-N
Molecular Weight 331.206 g/mol
SMILES C1OCc2cccc(COCCOCCOC1)c2Br
SPLASH splash10-001i-5900000000-8b179942a7add3a9970e
Synonyms 18-bromanyl-3,6,9,12-tetraoxabicyclo[12.3.1]octadeca-1(18),14,16-triene 18-Bromo-3,6,9,12-tetraoxabicyclo[12.3.1]octadeca-1(18),14,16-triene
Wiley ID 1490537