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VULGARIN=BARRELIN=JUDAICIN=TAUREMISIN-A
SpectraBase Compound ID Gdkq95f1mzt
InChI InChI=1S/C15H20O4/c1-8-9-4-6-14(2)10(16)5-7-15(3,18)12(14)11(9)19-13(8)17/h5,7-9,11-12,18H,4,6H2,1-3H3/t8-,9-,11-,12+,14-,15+/m0/s1
InChIKey NGPDZEACIWDCKX-WUDKWMPASA-N
Mol Weight 264.32 g/mol
Molecular Formula C15H20O4
Exact Mass 264.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9jZIRpB1InU
Name vulgarin
Alternate Name(s) (3S,3aS,5aR,9R,9aS,9bS)-9-hydroxy-3,5a,9-trimethyl-3a,5,5a,9,9a,9b-hexahydronaphtho[1,2-b]furan-2,6(3H,4H)-dione
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Formula C15H20O4
InChI InChI=1S/C15H20O4/c1-8-9-4-6-14(2)10(16)5-7-15(3,18)12(14)11(9)19-13(8)17/h5,7-9,11-12,18H,4,6H2,1-3H3/t8-,9-,11-,12+,14-,15+/m0/s1
InChIKey NGPDZEACIWDCKX-WUDKWMPASA-N
Literature Reference DOI 10.1002/cbdv.201700211
Molecular Weight 264.321 g/mol
SMILES O[C@@]1(C=CC([C@@]2(CC[C@@]3([C@](OC([C@]3(C)[H])=O)([C@@]12[H])[H])[H])C)=O)C
SPLASH splash10-001i-4930000000-85d74d046d6dbcba2abb
Source of Spectrum CBD-14-5-10
Wiley ID 1807996