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11,13-Dihydro-13-hydroxydeacylcynaropicrin
SpectraBase Compound ID ImRtR2e97Cg
InChI InChI=1S/C15H20O5/c1-6-3-11(18)13-9(5-16)15(19)20-14(13)12-7(2)10(17)4-8(6)12/h8-14,16-18H,1-5H2/t8-,9-,10-,11-,12-,13+,14+/m0/s1
InChIKey VVKKWWJLJGZSFI-CLSQCYNNSA-N
Mol Weight 280.32 g/mol
Molecular Formula C15H20O5
Exact Mass 280.131074 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F0OAk1lehds
Name 11,13-Dihydro-13-hydroxydeacylcynaropicrin
Comments Less than 3 mono-isotopic peaks
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Formula C15H20O5
InChI InChI=1S/C15H20O5/c1-6-3-11(18)13-9(5-16)15(19)20-14(13)12-7(2)10(17)4-8(6)12/h8-14,16-18H,1-5H2/t8-,9-,10-,11-,12-,13+,14+/m0/s1
InChIKey VVKKWWJLJGZSFI-CLSQCYNNSA-N
Molecular Weight 280.320 g/mol
SMILES OC[C@]1([C@]2([C@@]([C@]3(C([C@](C[C@]3(C(C[C@@]2(O)[H])=C)[H])(O)[H])=C)[H])(OC1=O)[H])[H])[H]
SPLASH splash10-00e9-0090000000-71d98ce82e81aa43bb55
Source of Spectrum F-62-7754-18
Wiley ID 1640385