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(4R,5S,7E,9Z,13Z)-14-(hydroxymethyl)-4,10-dimethyl-5-oxidanyl-7-propan-2-yl-cyclotetradeca-7,9,13-triene-1,6-dione
SpectraBase Compound ID 40pmsC6D2r9
InChI InChI=1S/C20H30O4/c1-13(2)17-10-8-14(3)6-5-7-16(12-21)18(22)11-9-15(4)19(23)20(17)24/h7-8,10,13,15,19,21,23H,5-6,9,11-12H2,1-4H3/b14-8-,16-7-,17-10+/t15-,19+/m1/s1
InChIKey IVLQHBCLTSYTPN-KBHTVENUSA-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 4BToTO3tgm
Name (4R,5S,7E,9Z,13Z)-14-(hydroxymethyl)-4,10-dimethyl-5-oxidanyl-7-propan-2-yl-cyclotetradeca-7,9,13-triene-1,6-dione
Alternate Name(s) (4R,5S,7E,9Z,13Z)-5-hydroxy-14-(hydroxymethyl)-4,10-dimethyl-7-propan-2-ylcyclotetradeca-7,9,13-triene-1,6-dione (4R,5S,7E,9Z,13Z)-5-hydroxy-14-(hydroxymethyl)-7-isopropyl-4,10-dimethyl-cyclotetradeca-7,9,13-triene-1,6-dione (4R,5S,7E,9Z,13Z)-5-hydroxy-7-isopropyl-4,10-dimethyl-14-methylol-cyclotetradeca-7,9,13-triene-1,6-quinone
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Formula C20H30O4
InChI InChI=1S/C20H30O4/c1-13(2)17-10-8-14(3)6-5-7-16(12-21)18(22)11-9-15(4)19(23)20(17)24/h7-8,10,13,15,19,21,23H,5-6,9,11-12H2,1-4H3/b14-8-,16-7-,17-10+/t15-,19+/m1/s1
InChIKey IVLQHBCLTSYTPN-KBHTVENUSA-N
Molecular Weight 334.456 g/mol
SMILES O[C@]1([C@@](CCC(\C(CO)=C\CC\C(=C/C=C/(C1=O)C(C)C)C)=O)(C)[H])[H]
SPLASH splash10-0xr0-0971000000-a7530ab2b725e7c47f39
Source of Spectrum F-55-1150-2
Wiley ID 836682