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Diethyl 2-(4-methoxyphenyl)-5-phenyl-5-(phenylethynyl)oxolane-3,3-dicarboxylate
SpectraBase Compound ID 79obmgPaSmK
InChI InChI=1S/C31H30O6/c1-4-35-28(32)31(29(33)36-5-2)22-30(25-14-10-7-11-15-25,21-20-23-12-8-6-9-13-23)37-27(31)24-16-18-26(34-3)19-17-24/h6-19,27H,4-5,22H2,1-3H3/t27-,30-/m1/s1
InChIKey PNMBUDXCAATXDP-POURPWNDSA-N
Mol Weight 498.58 g/mol
Molecular Formula C31H30O6
Exact Mass 498.204239 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DwBbj4IFPwe
Name Diethyl 2-(4-methoxyphenyl)-5-phenyl-5-(phenylethynyl)oxolane-3,3-dicarboxylate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H30O6
InChI InChI=1S/C31H30O6/c1-4-35-28(32)31(29(33)36-5-2)22-30(25-14-10-7-11-15-25,21-20-23-12-8-6-9-13-23)37-27(31)24-16-18-26(34-3)19-17-24/h6-19,27H,4-5,22H2,1-3H3/t27-,30-/m1/s1
InChIKey PNMBUDXCAATXDP-POURPWNDSA-N
Literature Reference DOI 10.1021/ol400809n
Molecular Weight 498.575 g/mol
SMILES C1(C(OCC)=O)([C@@](c2ccc(cc2)OC)(O[C@](C1)(c1ccccc1)C#Cc1ccccc1)[H])C(OCC)=O
SPLASH splash10-01p9-0295000000-fdcadb1d068d162a468f
Source of Spectrum A1-15-2262/SMS11-trans_3k
Synonyms (2R,5R)-diethyl 2-(4-methoxyphenyl)-5-phenyl-5-(phenylethynyl)dihydrofuran-3,3(2H)-dicarboxylate
Wiley ID 1748611