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7-[2',4',6'-Trihydroxytridecyl]- (perhydro)bipyran-1-one
SpectraBase Compound ID 2IfsCvx1LPi
InChI InChI=1S/C20H36O6/c1-2-3-4-5-6-7-14(21)8-15(22)9-17-12-18-10-16-11-19(13-20(23)24-16)26(18)27-25-17/h14-19,21-22H,2-13H2,1H3/t14-,15-,16+,17+,18-,19-/m1/s1
InChIKey RTJDDXPWXZUGOR-RCFCFVIZSA-N
Mol Weight 372.5 g/mol
Molecular Formula C20H36O6
Exact Mass 372.251189 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2C5t7EdHeuU
Name 7-[2',4',6'-Trihydroxytridecyl]- (perhydro)bipyran-1-one
Alternate Name(s) Polyrhacitide B
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Formula C20H36O6
InChI InChI=1S/C20H36O6/c1-2-3-4-5-6-7-14(21)8-15(22)9-17-12-18-10-16-11-19(13-20(23)24-16)26(18)27-25-17/h14-19,21-22H,2-13H2,1H3/t14-,15-,16+,17+,18-,19-/m1/s1
InChIKey RTJDDXPWXZUGOR-RCFCFVIZSA-N
Molecular Weight 372.502 g/mol
SMILES O[C@@](C[C@](C[C@]1(C[C@@]2([O]([C@]3(CC(O[C@](C3)(C2)[H])=O)[H])[H]O1)[H])[H])(O)[H])(CCCCCCC)[H]
SPLASH splash10-000i-0009000000-8174b6a3bc889f84747f
Source of Spectrum G4-71-726-2
Wiley ID 1694922