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Methyl 5-[(1',1'-biphenyl-4'-yl)carbonyloxy]-3-(phenylselenyl)-2-oxabicyclo2.2.1]hept-7-ylacetate
SpectraBase Compound ID 6acHazOVWkO
InChI InChI=1S/C28H26O5Se/c1-31-26(29)16-24-23-18-32-28(24,34-22-10-6-3-7-11-22)17-25(23)33-27(30)21-14-12-20(13-15-21)19-8-4-2-5-9-19/h2-15,23-25H,16-18H2,1H3/t23-,24?,25?,28+/m1/s1
InChIKey IGHOJKPFMXNXOY-ZQNOOOKSSA-N
Mol Weight 521.48 g/mol
Molecular Formula C28H26O5Se
Exact Mass 522.094546 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8VsTDS73Ja9
Name Methyl 5-[(1',1'-biphenyl-4'-yl)carbonyloxy]-3-(phenylselenyl)-2-oxabicyclo2.2.1]hept-7-ylacetate
Alternate Name(s) 7-(2-Methoxy-2-oxoethyl)-1-(phenylselanyl)-2-oxabicyclo[2.2.1]hept-5-yl[1,1'-biphenyl]-4-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H26O5Se
InChI InChI=1S/C28H26O5Se/c1-31-26(29)16-24-23-18-32-28(24,34-22-10-6-3-7-11-22)17-25(23)33-27(30)21-14-12-20(13-15-21)19-8-4-2-5-9-19/h2-15,23-25H,16-18H2,1H3/t23-,24?,25?,28+/m1/s1
InChIKey IGHOJKPFMXNXOY-ZQNOOOKSSA-N
Molecular Weight 521.483 g/mol
SMILES [C@@]12(C([C@@](CO2)(C(C1)OC(c1ccc(cc1)-c1ccccc1)=O)[H])CC(=O)OC)[Se]c1ccccc1
SPLASH splash10-001i-8904000000-433b095e68565a4f2514
Source of Spectrum H-77-1786-10
Wiley ID 1402234