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SpectraBase Compound ID 4bCk5ud12L2
InChI InChI=1S/C23H31NO4/c1-14(2)7-5-8-15(3)9-6-10-23(4)20(26)12-17-19(25)11-16-18(21(17)28-23)13-24-22(16)27/h7,9,11,20,25-26H,5-6,8,10,12-13H2,1-4H3,(H,24,27)/b15-9+/t20-,23-/m0/s1
InChIKey XGUHYRYUXUVLOK-BHNVPJQESA-N
Mol Weight 385.5 g/mol
Molecular Formula C23H31NO4
Exact Mass 385.225308 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5kFL1Q1BvFZ
Name (2S,3S)-2-[(3E)-4,8-dimethylnona-3,7-dienyl]-2-methyl-3,5-bis(oxidanyl)-3,4,8,9-tetrahydropyrano[2,3-e]isoindol-7-one
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Formula C23H31NO4
InChI InChI=1S/C23H31NO4/c1-14(2)7-5-8-15(3)9-6-10-23(4)20(26)12-17-19(25)11-16-18(21(17)28-23)13-24-22(16)27/h7,9,11,20,25-26H,5-6,8,10,12-13H2,1-4H3,(H,24,27)/b15-9+/t20-,23-/m0/s1
InChIKey XGUHYRYUXUVLOK-BHNVPJQESA-N
Molecular Weight 385.504 g/mol
SMILES N1C(c2c(c3O[C@]([C@](Cc3c(c2)O)(O)[H])(CC\C=C\(CCC=C(C)C)C)C)C1)=O
SPLASH splash10-016r-9814000000-cdcff4249e207411d147
Source of Spectrum J-57-6702-2
Synonyms (2S,3S)-2-[(3E)-4,8-dimethylnona-3,7-dienyl]-3,5-dihydroxy-2-methyl-3,4,8,9-tetrahydropyrano[2,3-e]isoindol-7-one (2S,3S)-2-[(3E)-4,8-dimethylnona-3,7-dienyl]-3,5-dihydroxy-2-methyl-3,4,8,9-tetrahydropyran[2,3-e]isoindol-7-one
Wiley ID 1362282