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Ethyl 6-(1-adamantyl)-2-oxo-4-phenyl-2H-pyran-3-carboxylate
SpectraBase Compound ID 5oOUQzfknsh
InChI InChI=1S/C24H26O4/c1-2-27-22(25)21-19(18-6-4-3-5-7-18)11-20(28-23(21)26)24-12-15-8-16(13-24)10-17(9-15)14-24/h3-7,11,15-17H,2,8-10,12-14H2,1H3/t15-,16+,17-,24-
InChIKey VUOUEWRYCZRYSN-ONHXBKDTSA-N
Mol Weight 378.47 g/mol
Molecular Formula C24H26O4
Exact Mass 378.183109 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DPdop6Ya9bP
Name Ethyl 6-(1-adamantyl)-2-oxo-4-phenyl-2H-pyran-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H26O4
InChI InChI=1S/C24H26O4/c1-2-27-22(25)21-19(18-6-4-3-5-7-18)11-20(28-23(21)26)24-12-15-8-16(13-24)10-17(9-15)14-24/h3-7,11,15-17H,2,8-10,12-14H2,1H3/t15-,16+,17-,24-
InChIKey VUOUEWRYCZRYSN-ONHXBKDTSA-N
Literature Reference DOI 10.1039/c3cc46788k
Molecular Weight 378.468 g/mol
SMILES C1[C@]2(C[C@]3(C[C@@]1(CC(C2)(C3)C1=CC(=C(C(O1)=O)C(OCC)=O)c1ccccc1)[H])[H])[H]
SPLASH splash10-0udi-0049000000-4598629fa8ec8830aa1d
Source of Spectrum KD-50-542/SM-8g
Synonyms Ethyl 6-((3r,5r,7r)-adamantan-1-yl)-2-oxo-4-phenyl-2H-pyran-3-carboxylate
Wiley ID 1754212