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Diethyl 2-bromo-11-Methyl-1,11-dodecadiene-6-yne-4,4-dicarbocxylate
SpectraBase Compound ID 5R8M6gaHU1Y
InChI InChI=1S/C19H27BrO4/c1-6-23-17(21)19(14-16(5)20,18(22)24-7-2)13-11-9-8-10-12-15(3)4/h3,5-8,10,12-14H2,1-2,4H3
InChIKey GNOPFTMGEHQTKM-UHFFFAOYSA-N
Mol Weight 399.33 g/mol
Molecular Formula C19H27BrO4
Exact Mass 398.109272 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bvan5XZ54fo
Name Diethyl 2-bromo-11-Methyl-1,11-dodecadiene-6-yne-4,4-dicarbocxylate
Alternate Name(s) Diethyl 2-(2-bromo-2-propenyl)-2-(7-methyl-7-octen-2-ynyl)malonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H27BrO4
InChI InChI=1S/C19H27BrO4/c1-6-23-17(21)19(14-16(5)20,18(22)24-7-2)13-11-9-8-10-12-15(3)4/h3,5-8,10,12-14H2,1-2,4H3
InChIKey GNOPFTMGEHQTKM-UHFFFAOYSA-N
Molecular Weight 399.325 g/mol
SMILES C(C(=O)OCC)(C(=O)OCC)(CC(=C)Br)CC#CCCCC(=C)C
SPLASH splash10-006w-9520000000-9f4830a1a21aebe58889
Source of Spectrum F-52-11576-58
Wiley ID 798480