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3-Methyl-4-[1'-bromohept-2'(Z)-en-2'-yl]-5-(naphth-1"-yl)furan-2(5H)-one
SpectraBase Compound ID 2aod9CQG47x
InChI InChI=1S/C22H23BrO2/c1-3-4-5-10-17(14-23)20-15(2)22(24)25-21(20)19-13-8-11-16-9-6-7-12-18(16)19/h6-13,21H,3-5,14H2,1-2H3/b17-10+
InChIKey UANSJGUNJQTHQI-LICLKQGHSA-N
Mol Weight 399.33 g/mol
Molecular Formula C22H23BrO2
Exact Mass 398.088143 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9JsBQSimAHP
Name 3-Methyl-4-[1'-bromohept-2'(Z)-en-2'-yl]-5-(naphth-1"-yl)furan-2(5H)-one
Comments Less than 3 mono-isotopic peaks
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Formula C22H23BrO2
InChI InChI=1S/C22H23BrO2/c1-3-4-5-10-17(14-23)20-15(2)22(24)25-21(20)19-13-8-11-16-9-6-7-12-18(16)19/h6-13,21H,3-5,14H2,1-2H3/b17-10+
InChIKey UANSJGUNJQTHQI-LICLKQGHSA-N
Molecular Weight 399.328 g/mol
SMILES C1(C(=C(C)C(O1)=O)\C(=C\CCCC)CBr)c1c2c(cccc2)ccc1
SPLASH splash10-014i-0009000000-69e3dd114e4a18b607dd
Source of Spectrum C-129-10953-Z-5fa
Wiley ID 1701865