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Diethyl 2-Bromo-14-hydroxy-14-ethyl-8-methoxy-1-hexadecene-6,12-diyne-4,4-dicarboxylate
SpectraBase Compound ID LCQOMxGDOkT
InChI InChI=1S/C25H37BrO6/c1-7-24(29,8-2)17-13-11-12-15-21(30-6)16-14-18-25(19-20(5)26,22(27)31-9-3)23(28)32-10-4/h21,29H,5,7-12,15,18-19H2,1-4,6H3
InChIKey ZLTYBBQTSHCTRL-UHFFFAOYSA-N
Mol Weight 513.5 g/mol
Molecular Formula C25H37BrO6
Exact Mass 512.177352 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A359dHVribI
Name Diethyl 2-Bromo-14-hydroxy-14-ethyl-8-methoxy-1-hexadecene-6,12-diyne-4,4-dicarboxylate
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Formula C25H37BrO6
InChI InChI=1S/C25H37BrO6/c1-7-24(29,8-2)17-13-11-12-15-21(30-6)16-14-18-25(19-20(5)26,22(27)31-9-3)23(28)32-10-4/h21,29H,5,7-12,15,18-19H2,1-4,6H3
InChIKey ZLTYBBQTSHCTRL-UHFFFAOYSA-N
Molecular Weight 513.469 g/mol
SMILES OC(C#CCCCC(C#CCC(C(=O)OCC)(C(=O)OCC)CC(=C)Br)OC)(CC)CC
SPLASH splash10-0a4i-9000100000-b200ee5ec6439fe4e481
Source of Spectrum U1-2008-6160-10a
Wiley ID 1662348