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[1-(S)-(4-[2.2]paracyclophanyl)-3-phenyl]propane-1,3-dione

View entire compound with spectra: 1 MS (GC)

[1-(S)-(4-[2.2]paracyclophanyl)-3-phenyl]propane-1,3-dione
SpectraBase Compound ID J0Wy01cW4Ep
InChI InChI=1S/C25H22O2/c26-24(22-4-2-1-3-5-22)17-25(27)23-16-20-11-10-18-6-8-19(9-7-18)12-14-21(23)15-13-20/h1-9,13,15-16H,10-12,14,17H2
InChIKey GXIWVDVSROAWPM-UHFFFAOYSA-N
Mol Weight 354.45 g/mol
Molecular Formula C25H22O2
Exact Mass 354.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2FwSKagiMRE
Name [1-(S)-(4-[2.2]paracyclophanyl)-3-phenyl]propane-1,3-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H22O2
InChI InChI=1S/C25H22O2/c26-24(22-4-2-1-3-5-22)17-25(27)23-16-20-11-10-18-6-8-19(9-7-18)12-14-21(23)15-13-20/h1-9,13,15-16H,10-12,14,17H2
InChIKey GXIWVDVSROAWPM-UHFFFAOYSA-N
Molecular Weight 354.449 g/mol
SMILES C(c1c2ccc(c1)CCc1ccc(CC2)cc1)(CC(=O)c1ccccc1)=O
SPLASH splash10-01t9-0901000000-a146397df1a635cd7bff
Source of Spectrum QC-10-516-6
Wiley ID 871110