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Psoralester
SpectraBase Compound ID FnDyBIcGF4z
InChI InChI=1S/C22H38O4/c1-2-3-4-5-6-7-8-9-10-13-16-22(24)26-20-15-12-11-14-19-25-21(23)18-17-20/h11,14,20H,2-10,12-13,15-19H2,1H3/b14-11-/t20-/m1/s1
InChIKey WHOHJKFQKCSVPQ-ACQXMXPUSA-N
Mol Weight 366.5 g/mol
Molecular Formula C22H38O4
Exact Mass 366.27701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IT3cinqUq
Name Psoralester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H38O4
InChI InChI=1S/C22H38O4/c1-2-3-4-5-6-7-8-9-10-13-16-22(24)26-20-15-12-11-14-19-25-21(23)18-17-20/h11,14,20H,2-10,12-13,15-19H2,1H3/b14-11-/t20-/m1/s1
InChIKey WHOHJKFQKCSVPQ-ACQXMXPUSA-N
Molecular Weight 366.542 g/mol
SMILES C1\C=C/COC(CC[C@](C1)([H])OC(=O)CCCCCCCCCCCC)=O
SPLASH splash10-0uxu-8964000000-bd12cf59bc44364c1c9a
Source of Spectrum Y1-49B-258-1
Synonyms (R,Z)-2-oxo-3,4,5,6,7,10-hexahydro-2H-oxecin-5-yl tridecanoate
Wiley ID 1744589