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3-Bromo-2,2-dibutyl-2H-1-benzopyran
SpectraBase Compound ID GJKmeE6Vb3t
InChI InChI=1S/C17H23BrO/c1-3-5-11-17(12-6-4-2)16(18)13-14-9-7-8-10-15(14)19-17/h7-10,13H,3-6,11-12H2,1-2H3
InChIKey DXERUPITYJLNRM-UHFFFAOYSA-N
Mol Weight 323.27 g/mol
Molecular Formula C17H23BrO
Exact Mass 322.093228 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2j38xdEFbWs
Name 3-Bromo-2,2-dibutyl-2H-1-benzopyran
Comments Less than 3 mono-isotopic peaks
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Formula C17H23BrO
InChI InChI=1S/C17H23BrO/c1-3-5-11-17(12-6-4-2)16(18)13-14-9-7-8-10-15(14)19-17/h7-10,13H,3-6,11-12H2,1-2H3
InChIKey DXERUPITYJLNRM-UHFFFAOYSA-N
Molecular Weight 323.274 g/mol
SMILES C1(Oc2c(C=C1Br)cccc2)(CCCC)CCCC
SPLASH splash10-014i-0091000000-ee3ec7bab710a1df2a8d
Source of Spectrum H1-38-826-6
Synonyms 3-bromo-2,2-dibutyl-2H-chromene
Wiley ID 756287