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(4'as,5's,8'as)-e-(+)-3-methyl-5-((5'.alpha.-(4'-methyl-3'-pentenyl)-2',5'.beta.,8'a.beta.,trimethyl-3',4',4'a,5',6',7',8',8'a-octahydronaphthalenyl))-2-pentenoic acid
SpectraBase Compound ID DARBEtcGbH0
InChI InChI=1S/C25H40O2/c1-18(2)9-7-14-24(5)15-8-16-25(6)21(20(4)11-13-22(24)25)12-10-19(3)17-23(26)27/h9,17,22H,7-8,10-16H2,1-6H3,(H,26,27)
InChIKey VMXBEUNFNFIWLY-UHFFFAOYSA-N
Mol Weight 372.6 g/mol
Molecular Formula C25H40O2
Exact Mass 372.302831 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EMPXPVsfCco
Name (4'as,5's,8'as)-e-(+)-3-methyl-5-((5'.alpha.-(4'-methyl-3'-pentenyl)-2',5'.beta.,8'a.beta.,trimethyl-3',4',4'a,5',6',7',8',8'a-octahydronaphthalenyl))-2-pentenoic acid
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Formula C25H40O2
InChI InChI=1S/C25H40O2/c1-18(2)9-7-14-24(5)15-8-16-25(6)21(20(4)11-13-22(24)25)12-10-19(3)17-23(26)27/h9,17,22H,7-8,10-16H2,1-6H3,(H,26,27)
InChIKey VMXBEUNFNFIWLY-UHFFFAOYSA-N
Ionization Type EI-B
Molecular Weight 372.593 g/mol
SMILES OC(C=C(CCC=1C2(C(C(CCC=C(C)C)(C)CCC2)CCC1C)C)C)=O
SPLASH splash10-0159-5910000000-971083d5310146b90ad7
Source of Spectrum SRH-2022-7993-0
Synonyms Dysideapalaunic acid
Wiley ID 1829708