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3-Ethyl-4-[1'-bromodec-2'(Z)-en-2'-yl]-5-phenylfuran-2(5H)-one
SpectraBase Compound ID C3H5Q86UBvD
InChI InChI=1S/C22H29BrO2/c1-3-5-6-7-8-10-15-18(16-23)20-19(4-2)22(24)25-21(20)17-13-11-9-12-14-17/h9,11-15,21H,3-8,10,16H2,1-2H3/b18-15+
InChIKey HXNPDXZWFKYCSL-OBGWFSINSA-N
Mol Weight 405.38 g/mol
Molecular Formula C22H29BrO2
Exact Mass 404.135093 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LTKXv5L3BTt
Name 3-Ethyl-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 C22H29BrO2
InChI InChI=1S/C22H29BrO2/c1-3-5-6-7-8-10-15-18(16-23)20-19(4-2)22(24)25-21(20)17-13-11-9-12-14-17/h9,11-15,21H,3-8,10,16H2,1-2H3/b18-15+
InChIKey HXNPDXZWFKYCSL-OBGWFSINSA-N
Molecular Weight 405.376 g/mol
SMILES C=1(C(OC(C1CC)=O)c1ccccc1)\C(=C\CCCCCCC)CBr
SPLASH splash10-0a4i-0900000000-c6f45cf491c9043aff30
Source of Spectrum C-129-10954-Z-5ic
Wiley ID 1701861