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4,13-Epoxy-3-hydroxycembra-7,15(17)-dien-16,14-olide
SpectraBase Compound ID 4D5YefjbBI8
InChI InChI=1S/C20H30O4/c1-12-7-5-9-13(2)17-18-15(14(3)19(22)23-18)11-16(21)20(4,24-17)10-6-8-12/h8,13,15-18,21H,3,5-7,9-11H2,1-2,4H3/b12-8-/t13-,15+,16-,17+,18-,20+/m1/s1
InChIKey KNYONISSVBFRJH-QTSLYBFGSA-N
Mol Weight 334.46 g/mol
Molecular Formula C20H30O4
Exact Mass 334.214409 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LJ3WTwSRowN
Name 4,13-Epoxy-3-hydroxycembra-7,15(17)-dien-16,14-olide
Comments Edited after expert review - Original record with SpectrumID 1549064 removed
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Formula C20H30O4
InChI InChI=1S/C20H30O4/c1-12-7-5-9-13(2)17-18-15(14(3)19(22)23-18)11-16(21)20(4,24-17)10-6-8-12/h8,13,15-18,21H,3,5-7,9-11H2,1-2,4H3/b12-8-/t13-,15+,16-,17+,18-,20+/m1/s1
InChIKey KNYONISSVBFRJH-QTSLYBFGSA-N
Molecular Weight 334.456 g/mol
SMILES O[C@@]1(C[C@@]2([C@@](OC(=O)C2=C)([C@]2(O[C@]1(CC\C=C/(CCC[C@]2(C)[H])C)C)[H])[H])[H])[H]
SPLASH splash10-0a7i-9400000000-ba1baa83339fa378a721
Source of Spectrum F-57-105-23
Wiley ID 1718246