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Diethyl 5-(but-1-ynyl)-2-(4-methoxyphenyl)-5-methyloxolane-3,3-dicarboxylate
SpectraBase Compound ID 3LyDIDehIP3
InChI InChI=1S/C22H28O6/c1-6-9-14-21(4)15-22(19(23)26-7-2,20(24)27-8-3)18(28-21)16-10-12-17(25-5)13-11-16/h10-13,18H,6-8,15H2,1-5H3/t18-,21-/m1/s1
InChIKey IVPBJSCVISSGIR-WIYYLYMNSA-N
Mol Weight 388.46 g/mol
Molecular Formula C22H28O6
Exact Mass 388.188589 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E2D43Rqm4Qj
Name Diethyl 5-(but-1-ynyl)-2-(4-methoxyphenyl)-5-methyloxolane-3,3-dicarboxylate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H28O6
InChI InChI=1S/C22H28O6/c1-6-9-14-21(4)15-22(19(23)26-7-2,20(24)27-8-3)18(28-21)16-10-12-17(25-5)13-11-16/h10-13,18H,6-8,15H2,1-5H3/t18-,21-/m1/s1
InChIKey IVPBJSCVISSGIR-WIYYLYMNSA-N
Literature Reference DOI 10.1021/ol400809n
Molecular Weight 388.460 g/mol
SMILES C1(C(OCC)=O)([C@](O[C@@](C1)(C#CCC)C)(c1ccc(cc1)OC)[H])C(OCC)=O
SPLASH splash10-0xr9-0893000000-e3752d4db4aea2a149cd
Source of Spectrum A1-15-2262/SMS13-trans_3o
Synonyms (2R,5S)-diethyl 5-(but-1-yn-1-yl)-2-(4-methoxyphenyl)-5-methyldihydrofuran-3,3(2H)-dicarboxylate
Wiley ID 1748614