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1-Methoxy-2-undecyl-tricyclo[7.5.2.1(5,8).0(4,9)]deca-1,6-dien-3-one.
SpectraBase Compound ID 5OV475WyQxH
InChI InChI=1S/C22H34O2/c1-3-4-5-6-7-8-9-10-11-12-18-21(23)19-16-13-14-17(15-16)20(19)22(18)24-2/h13-14,16-17,19-20H,3-12,15H2,1-2H3/t16-,17+,19+,20-/m0/s1
InChIKey KHGROFJLLSDEEU-UHFFFAOYSA-N
Mol Weight 330.5 g/mol
Molecular Formula C22H34O2
Exact Mass 330.25588 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E45O0KJuOng
Name 1-Methoxy-2-undecyl-tricyclo[7.5.2.1(5,8).0(4,9)]deca-1,6-dien-3-one.
Comments Less than 3 mono-isotopic peaks
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Formula C22H34O2
InChI InChI=1S/C22H34O2/c1-3-4-5-6-7-8-9-10-11-12-18-21(23)19-16-13-14-17(15-16)20(19)22(18)24-2/h13-14,16-17,19-20H,3-12,15H2,1-2H3/t16-,17+,19+,20-/m0/s1
InChIKey KHGROFJLLSDEEU-UHFFFAOYSA-N
Molecular Weight 330.512 g/mol
SMILES C1(=C(C(=O)[C@]2([C@@]1([C@@]1(C=C[C@]2(C1)[H])[H])[H])[H])CCCCCCCCCCC)OC
SPLASH splash10-03di-0090000000-d9efb2ad8e1bc8bb3c06
Source of Spectrum D1-2000-1020-5
Synonyms 5-methoxy-4-undecyltricyclo[5.2.1.0(2,6)]deca-4,8-dien-3-one
Wiley ID 835425