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13-[1'-(2"-Tetrahydropyranyloxy)ethyl]mokkolactone
SpectraBase Compound ID JQgVOilMNif
InChI InChI=1S/C22H32O4/c1-13-7-10-17-18(12-15(3)25-19-6-4-5-11-24-19)22(23)26-21(17)20-14(2)8-9-16(13)20/h15-21H,1-2,4-12H2,3H3/t15?,16-,17-,18?,19?,20-,21-/m0/s1
InChIKey AAZKGIOSMLTUGQ-KFTHNLDKSA-N
Mol Weight 360.5 g/mol
Molecular Formula C22H32O4
Exact Mass 360.23006 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LmwQZXtyX20
Name 13-[1'-(2"-Tetrahydropyranyloxy)ethyl]mokkolactone
Comments Less than 3 mono-isotopic peaks
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Formula C22H32O4
InChI InChI=1S/C22H32O4/c1-13-7-10-17-18(12-15(3)25-19-6-4-5-11-24-19)22(23)26-21(17)20-14(2)8-9-16(13)20/h15-21H,1-2,4-12H2,3H3/t15?,16-,17-,18?,19?,20-,21-/m0/s1
InChIKey AAZKGIOSMLTUGQ-KFTHNLDKSA-N
Molecular Weight 360.494 g/mol
SMILES [C@]12(OC(=O)C([C@@]2(CCC([C@]2([C@@]1(C(CC2)=C)[H])[H])=C)[H])CC(OC1OCCCC1)C)[H]
SPLASH splash10-000i-9000000000-d30d47cc8a3702cae8ad
Source of Spectrum F-62-7751-4
Wiley ID 1640398