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12-(exo)-p-Anisyl-8,8-dimethyl-tricyclo[5.4.0.1(3,6)]dodec-1(7)-en-4-one
SpectraBase Compound ID 5JfW73EFIRc
InChI InChI=1S/C21H26O2/c1-21(2)10-4-5-14-11-16-18(22)12-17(20(14)21)19(16)13-6-8-15(23-3)9-7-13/h6-9,16-17,19H,4-5,10-12H2,1-3H3/t16-,17+,19?/m1/s1
InChIKey NVGYWLPXDJJDNX-FQZXCLDYSA-N
Mol Weight 310.44 g/mol
Molecular Formula C21H26O2
Exact Mass 310.19328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CMfXsQze4bK
Name 12-(exo)-p-Anisyl-8,8-dimethyl-tricyclo[5.4.0.1(3,6)]dodec-1(7)-en-4-one
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Formula C21H26O2
InChI InChI=1S/C21H26O2/c1-21(2)10-4-5-14-11-16-18(22)12-17(20(14)21)19(16)13-6-8-15(23-3)9-7-13/h6-9,16-17,19H,4-5,10-12H2,1-3H3/t16-,17+,19?/m1/s1
InChIKey NVGYWLPXDJJDNX-FQZXCLDYSA-N
Molecular Weight 310.437 g/mol
SMILES C=12[C@@]3(C(c4ccc(cc4)OC)[C@](CC1CCCC2(C)C)(C(C3)=O)[H])[H]
SPLASH splash10-03di-0900000000-8e00d9c1026fce111c68
Source of Spectrum J-67-2240-9
Synonyms (9R,12R)-12-(4-methoxyphenyl)-3,3-dimethyltricyclo[7.2.1.0(2,7)]dodec-2(7)-en-10-one
Wiley ID 1569377