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Diethyl 2-bromo-8-allyloxyphenyloct-1-ene-6-yne-4,4-dicarboxylate
SpectraBase Compound ID 4Ljq44qRFea
InChI InChI=1S/C23H27BrO5/c1-5-16-29-20(19-12-9-8-10-13-19)14-11-15-23(17-18(4)24,21(25)27-6-2)22(26)28-7-3/h5,8-10,12-13,20H,1,4,6-7,15-17H2,2-3H3
InChIKey ULPREWOUOFRPMZ-UHFFFAOYSA-N
Mol Weight 463.37 g/mol
Molecular Formula C23H27BrO5
Exact Mass 462.104187 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4zgpNCYkDrl
Name Diethyl 2-bromo-8-allyloxyphenyloct-1-ene-6-yne-4,4-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H27BrO5
InChI InChI=1S/C23H27BrO5/c1-5-16-29-20(19-12-9-8-10-13-19)14-11-15-23(17-18(4)24,21(25)27-6-2)22(26)28-7-3/h5,8-10,12-13,20H,1,4,6-7,15-17H2,2-3H3
InChIKey ULPREWOUOFRPMZ-UHFFFAOYSA-N
Molecular Weight 463.368 g/mol
SMILES C(C(=O)OCC)(C(=O)OCC)(CC(=C)Br)CC#CC(c1ccccc1)OCC=C
SPLASH splash10-0a4i-3920000000-5ec3a2c5490a0f375f56
Source of Spectrum F-52-11561-15
Synonyms Diethyl 2-allyl-2-[4-(allyloxy)-4-(2-bromophenyl)-2-butynyl]malonate Diethyl 2-bromo-8-allyloxy-8-phenyl-oct-1-ene-6-yne-4,4-dicarboxylate
Wiley ID 798516