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NIGERAPYRONE_F
SpectraBase Compound ID DOFD21QWmHz
InChI InChI=1S/C20H20O3/c1-15(11-16(2)12-17-7-5-4-6-8-17)9-10-18-13-19(22-3)14-20(21)23-18/h4-14H,1-3H3/b10-9+,15-11+,16-12-
InChIKey NLLRTVRDMOKHDF-CUEQUERMSA-N
Mol Weight 308.38 g/mol
Molecular Formula C20H20O3
Exact Mass 308.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1a1XcETRgYi
Name Nigerapyrone F
Appearance Yellowish, amorphous powder
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20O3
InChI InChI=1S/C20H20O3/c1-15(11-16(2)12-17-7-5-4-6-8-17)9-10-18-13-19(22-3)14-20(21)23-18/h4-14H,1-3H3/b10-9+,15-11+,16-12-
InChIKey NLLRTVRDMOKHDF-CUEQUERMSA-N
Instrument Name VG Autospec 3000
Ionization Type EI
Literature Reference DOI 10.1021/np200381u
Molecular Weight 308.377 g/mol
Reported Formula C20H20O3
SMILES C=1(OC(C=C(C1)OC)=O)\C=C\C(C)=C\C(=C/c1ccccc1)C
SPLASH splash10-004i-0901000000-07bd4d9654a259099519
Source of Spectrum G4-74-1791-8
Wiley ID 1849206