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6-BROMOMETHYL-2-DIBROMOMETHYL-3,5-DIPHENYL-4-H-PYRAN-4-ONE
SpectraBase Compound ID 47ErhC7T9j9
InChI InChI=1S/C19H13Br3O2/c20-11-14-15(12-7-3-1-4-8-12)17(23)16(18(24-14)19(21)22)13-9-5-2-6-10-13/h1-10,19H,11H2
InChIKey VHNSNCVKZGTLFW-UHFFFAOYSA-N
Mol Weight 513.02 g/mol
Molecular Formula C19H13Br3O2
Exact Mass 509.846569 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6dRkGt6PSJX
Name 2-(bromomethyl)-6-(dibromomethyl)-3,5-diphenyl-4-pyranone
Alternate Name(s) 2-(bromomethyl)-6-(dibromomethyl)-3,5-diphenyl-pyran-4-one 2-[bis(bromanyl)methyl]-6-(bromomethyl)-3,5-diphenyl-pyran-4-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H13Br3O2
InChI InChI=1S/C19H13Br3O2/c20-11-14-15(12-7-3-1-4-8-12)17(23)16(18(24-14)19(21)22)13-9-5-2-6-10-13/h1-10,19H,11H2
InChIKey VHNSNCVKZGTLFW-UHFFFAOYSA-N
Molecular Weight 513.023 g/mol
SMILES C1(=C(C(C(=C(O1)CBr)c1ccccc1)=O)c1ccccc1)C(Br)Br
SPLASH splash10-03di-0000090000-9e1636c9483e0a3d95fb
Source of Spectrum I-85-354-7
Wiley ID 1584865