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1-[2',2'-Bis(ethoxycarbonyl)-4'-bromopent-4'-enyl]-5-dimethylamino-3-ethoxy-5-propyl-1,3-cyclopentadiene
SpectraBase Compound ID 55Zs91G9UlO
InChI InChI=1S/C23H36BrNO5/c1-8-12-23(25(6)7)16-19(28-9-2)13-18(23)15-22(14-17(5)24,20(26)29-10-3)21(27)30-11-4/h13,16H,5,8-12,14-15H2,1-4,6-7H3
InChIKey UEQVGYWNCQDFHJ-UHFFFAOYSA-N
Mol Weight 486.4 g/mol
Molecular Formula C23H36BrNO5
Exact Mass 485.177686 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 63bFJPD8VbT
Name 1-[2',2'-Bis(ethoxycarbonyl)-4'-bromopent-4'-enyl]-5-dimethylamino-3-ethoxy-5-propyl-1,3-cyclopentadiene
Alternate Name(s) Diethyl 2-(2-bromo-2-propenyl)-2-{[5-(dimethylamino)-3-ethoxy-5-propyl-1,3-cyclopentadien-1-yl]methyl}malonate 2-(2-bromoprop-2-enyl)-2-[[5-(dimethylamino)-3-ethoxy-5-propyl-1-cyclopenta-1,3-dienyl]methyl]propanedioic acid diethyl ester Diethyl 2-(2-bromoprop-2-enyl)-2-[[5-(dimethylamino)-3-ethoxy-5-propylcyclopenta-1,3-dien-1-yl]methyl]propanedioate Diethyl 2-(2-bromoallyl)-2-[[5-(dimethylamino)-3-ethoxy-5-propyl-cyclopenta-1,3-dien-1-yl]methyl]propanedioate Diethyl 2-(2-bromanylprop-2-enyl)-2-[[5-(dimethylamino)-3-ethoxy-5-propyl-cyclopenta-1,3-dien-1-yl]methyl]propanedioate
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Formula C23H36BrNO5
InChI InChI=1S/C23H36BrNO5/c1-8-12-23(25(6)7)16-19(28-9-2)13-18(23)15-22(14-17(5)24,20(26)29-10-3)21(27)30-11-4/h13,16H,5,8-12,14-15H2,1-4,6-7H3
InChIKey UEQVGYWNCQDFHJ-UHFFFAOYSA-N
Molecular Weight 486.447 g/mol
SMILES C(CC=1C(C=C(C1)OCC)(N(C)C)CCC)(C(=O)OCC)(C(=O)OCC)CC(=C)Br
SPLASH splash10-0a4i-0290500000-780c818ac279035d0543
Source of Spectrum K1-2004-735-7
Wiley ID 1560394