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Diethyl 2-bromo-8-methoxy-1-undecene-6-yne-11-al-4,4-dicarboxylate
SpectraBase Compound ID FHZRPWosaAr
InChI InChI=1S/C18H25BrO6/c1-5-24-16(21)18(13-14(3)19,17(22)25-6-2)11-7-9-15(23-4)10-8-12-20/h12,15H,3,5-6,8,10-11,13H2,1-2,4H3
InChIKey JCOOVUWLUJZQFS-UHFFFAOYSA-N
Mol Weight 417.3 g/mol
Molecular Formula C18H25BrO6
Exact Mass 416.083452 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3NL8izDc0
Name Diethyl 2-bromo-8-methoxy-1-undecene-6-yne-11-al-4,4-dicarboxylate
Alternate Name(s) Diethyl 2-(2-bromo-2-propenyl)-2-(4-methoxy-7-oxo-2-heptynyl)malonate
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Formula C18H25BrO6
InChI InChI=1S/C18H25BrO6/c1-5-24-16(21)18(13-14(3)19,17(22)25-6-2)11-7-9-15(23-4)10-8-12-20/h12,15H,3,5-6,8,10-11,13H2,1-2,4H3
InChIKey JCOOVUWLUJZQFS-UHFFFAOYSA-N
Molecular Weight 417.296 g/mol
SMILES C(C(=O)OCC)(C(=O)OCC)(CC(=C)Br)CC#CC(OC)CCC=O
SPLASH splash10-052f-9721000000-5eaf95875a3ffde819d7
Source of Spectrum F-52-11573-50
Wiley ID 798486