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Ceratopyrone A

View entire compound with spectra: 1 MS (GC)

Ceratopyrone A
SpectraBase Compound ID IFbARUkxMxE
InChI InChI=1S/C21H30O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-17-20(23-2)18-21(22)24-19/h3-4,13-18H,5-12H2,1-2H3/b4-3+,14-13+,16-15+
InChIKey DNFXGOXBILBXTD-MHIMLCKZSA-N
Mol Weight 330.47 g/mol
Molecular Formula C21H30O3
Exact Mass 330.219495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9hGI1gG94rQ
Name Ceratopyrone A
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H30O3
InChI InChI=1S/C21H30O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-17-20(23-2)18-21(22)24-19/h3-4,13-18H,5-12H2,1-2H3/b4-3+,14-13+,16-15+
InChIKey DNFXGOXBILBXTD-MHIMLCKZSA-N
Molecular Weight 330.468 g/mol
SMILES C=1C(OC(=CC1OC)\C=C\C=C\CCCCCCCC\C=C\C)=O
SPLASH splash10-003r-0914000000-cb64ba009a431a46cf48
Source of Spectrum U-1995-84-1
Synonyms 4-Methoxy-6-[(1E,3E,13E)-1,3,13-pentadecatrienyl]-2H-pyran-2-one 6-(Pentadeca-1',3',13'-trienyl)-4-methoxypyran-2-one
Wiley ID 766382