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DEBILISONE_A
SpectraBase Compound ID EzSzxaUGs6
InChI InChI=1S/C25H40O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23-21-24(22-26)28-25(23)27/h23-24,26H,2-6,11-22H2,1H3/t23-,24-/m0/s1
InChIKey DOLRGEUCSXXZRK-ZEQRLZLVSA-N
Mol Weight 388.6 g/mol
Molecular Formula C25H40O3
Exact Mass 388.297745 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID jJeJJrnAe
Name Debilisone A
Appearance White amorphous solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H40O3
InChI InChI=1S/C25H40O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23-21-24(22-26)28-25(23)27/h23-24,26H,2-6,11-22H2,1H3/t23-,24-/m0/s1
InChIKey DOLRGEUCSXXZRK-ZEQRLZLVSA-N
Instrument Name Varian CP-3800 GC 1200 L Quadrupole
Ionization Type EI
Literature Reference DOI 10.1021/np1001913
Molecular Weight 388.592 g/mol
Optical Rotation [a]D23 = +22.0 (c = 0.206, CHCl3)
Reported Formula C25H40O3
SMILES OC[C@]1(OC([C@](C1)(CCCCCCCCCCC#CC#CCCCCCC)[H])=O)[H]
SPLASH splash10-052f-9300000000-2c801f730994680274be
Source of Spectrum G4-73-SM4-1
Wiley ID 1849001