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Diethyl 2-bromo-8-methoxy-11-(tetrahydropyranyl-2-oxy)-1-undecene-6-yne-4,4-dicarboxylate
SpectraBase Compound ID 8Tf8RiftoLd
InChI InChI=1S/C22H33BrO7/c1-4-27-20(25)22(16-17(3)23,21(26)28-5-2)13-8-10-18(24)11-9-15-30-19-12-6-7-14-29-19/h18-19,24H,3-7,9,11-16H2,1-2H3
InChIKey ZACJCSRZEOMHSI-UHFFFAOYSA-N
Mol Weight 489.4 g/mol
Molecular Formula C22H33BrO7
Exact Mass 488.140966 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7lKkAXTwOtC
Name Diethyl 2-bromo-8-methoxy-11-(tetrahydropyranyl-2-oxy)-1-undecene-6-yne-4,4-dicarboxylate
Alternate Name(s) Diethyl 2-bromo-8-hydroxy-11-(tetrahydropyranyl-2-oxy)-1-undecene-6-yne-4,4-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H33BrO7
InChI InChI=1S/C22H33BrO7/c1-4-27-20(25)22(16-17(3)23,21(26)28-5-2)13-8-10-18(24)11-9-15-30-19-12-6-7-14-29-19/h18-19,24H,3-7,9,11-16H2,1-2H3
InChIKey ZACJCSRZEOMHSI-UHFFFAOYSA-N
Molecular Weight 489.403 g/mol
SMILES OC(C#CCC(C(=O)OCC)(C(=O)OCC)CC(=C)Br)CCCOC1OCCCC1
SPLASH splash10-000i-9100000000-6c709a14af3c4fe7f10e
Source of Spectrum F-52-11572-48
Wiley ID 798488