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3-Methyl-4-[1'-bromodec-2'(Z)-en-2'-yl]-5-phenylfuran-2(5H)-one
SpectraBase Compound ID ES9AWf7PYLm
InChI InChI=1S/C21H27BrO2/c1-3-4-5-6-7-9-14-18(15-22)19-16(2)21(23)24-20(19)17-12-10-8-11-13-17/h8,10-14,20H,3-7,9,15H2,1-2H3/b18-14+
InChIKey HMHJGMXOJATQDR-NBVRZTHBSA-N
Mol Weight 391.35 g/mol
Molecular Formula C21H27BrO2
Exact Mass 390.119443 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jl1KUZvslPV
Name 3-Methyl-4-[1'-bromodec-2'(Z)-en-2'-yl]-5-phenylfuran-2(5H)-one
Comments Less than 3 mono-isotopic peaks
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Formula C21H27BrO2
InChI InChI=1S/C21H27BrO2/c1-3-4-5-6-7-9-14-18(15-22)19-16(2)21(23)24-20(19)17-12-10-8-11-13-17/h8,10-14,20H,3-7,9,15H2,1-2H3/b18-14+
InChIKey HMHJGMXOJATQDR-NBVRZTHBSA-N
Molecular Weight 391.349 g/mol
SMILES C=1(C(OC(C1C)=O)c1ccccc1)\C(=C\CCCCCCC)CBr
SPLASH splash10-0a4i-0900000000-bbba697a0c622d86f55d
Source of Spectrum C-129-10953-Z-5ac
Wiley ID 1701863