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NIGERAPYRONE_A;6-(4,6-DIMETHYLBIPHENYL-2-YL)-4-METHOXY-2-H-PYRAN-2-ONE
SpectraBase Compound ID 93qmi4Flt3R
InChI InChI=1S/C20H18O3/c1-13-9-14(2)20(15-7-5-4-6-8-15)17(10-13)18-11-16(22-3)12-19(21)23-18/h4-12H,1-3H3
InChIKey PKGPVVFVJPDDHE-UHFFFAOYSA-N
Mol Weight 306.36 g/mol
Molecular Formula C20H18O3
Exact Mass 306.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9Cb3t1CsfCc
Name Nigerapyrone A
Appearance Yellowish, amorphous powder
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H18O3
InChI InChI=1S/C20H18O3/c1-13-9-14(2)20(15-7-5-4-6-8-15)17(10-13)18-11-16(22-3)12-19(21)23-18/h4-12H,1-3H3
InChIKey PKGPVVFVJPDDHE-UHFFFAOYSA-N
Instrument Name VG Autospec 3000
Ionization Type EI
Literature Reference DOI 10.1021/np200381u
Molecular Weight 306.361 g/mol
Reported Formula C20H18O3
SMILES c1cccc(c1)-c1c(cc(cc1C)C)C=1OC(C=C(C1)OC)=O
SPLASH splash10-0a5a-0094000000-a499273630d9056dc22d
Source of Spectrum G4-74-1790-1
Wiley ID 1849201