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Diethyl 2-bromo-8-hydroxy-12-methyltridec-1,11-diene-6-yne-4,4-dicarboxylate
SpectraBase Compound ID Kvi3SWH8SsR
InChI InChI=1S/C20H29BrO5/c1-6-25-18(23)20(14-16(5)21,19(24)26-7-2)13-9-12-17(22)11-8-10-15(3)4/h10,17,22H,5-8,11,13-14H2,1-4H3
InChIKey MAYRKRIDTCEXCK-UHFFFAOYSA-N
Mol Weight 429.35 g/mol
Molecular Formula C20H29BrO5
Exact Mass 428.119837 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2jNu6TX5uIZ
Name Diethyl 2-bromo-8-hydroxy-12-methyltridec-1,11-diene-6-yne-4,4-dicarboxylate
Alternate Name(s) Diethyl 2-(2-bromo-2-propenyl)-2-(4-hydroxy-8-methyl-7-nonen-2-ynyl)malonate
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Formula C20H29BrO5
InChI InChI=1S/C20H29BrO5/c1-6-25-18(23)20(14-16(5)21,19(24)26-7-2)13-9-12-17(22)11-8-10-15(3)4/h10,17,22H,5-8,11,13-14H2,1-4H3
InChIKey MAYRKRIDTCEXCK-UHFFFAOYSA-N
Molecular Weight 429.351 g/mol
SMILES OC(C#CCC(C(=O)OCC)(C(=O)OCC)CC(=C)Br)CCC=C(C)C
SPLASH splash10-0aou-9120000000-b1e6bebaeb77e9e4dc4b
Source of Spectrum F-52-11571-45
Wiley ID 798491