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(E,6R*,8R*)-8-Methyl-1,7-dioxaspiro[5.6]dodec-9-ylideneacetonitrile
SpectraBase Compound ID 8MrSfkEgq3j
InChI InChI=1S/C13H19NO2/c1-11-12(6-9-14)5-4-8-13(16-11)7-2-3-10-15-13/h6,11H,2-5,7-8,10H2,1H3/b12-6+/t11-,13+/m1/s1
InChIKey DPTIHJCIBVMIRR-YPCNAFTDSA-N
Mol Weight 221.3 g/mol
Molecular Formula C13H19NO2
Exact Mass 221.141579 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EEceDSSpF3S
Name (E,6R*,8R*)-8-Methyl-1,7-dioxaspiro[5.6]dodec-9-ylideneacetonitrile
Alternate Name(s) (2E)-2-[(6R,11R)-11-methyl-5,12-dioxaspiro[5.6]dodecan-10-ylidene]acetonitrile (2E)-2-[(6R,11R)-11-methyl-5,12-dioxaspiro[5.6]dodecan-10-ylidene]ethanenitrile (2E)-[(6R,8R)-8-methyl-1,7-dioxaspiro[5.6]dodec-9-ylidene]ethanenitrile (2E)-2-[(6R,8R)-8-methyl-1,7-dioxaspiro[5.6]dodecan-9-ylidene]ethanenitrile
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Formula C13H19NO2
InChI InChI=1S/C13H19NO2/c1-11-12(6-9-14)5-4-8-13(16-11)7-2-3-10-15-13/h6,11H,2-5,7-8,10H2,1H3/b12-6+/t11-,13+/m1/s1
InChIKey DPTIHJCIBVMIRR-YPCNAFTDSA-N
Molecular Weight 221.300 g/mol
SMILES [C@@]12(O[C@@](\C(CCC2)=C/C#N)(C)[H])OCCCC1
SPLASH splash10-0zmi-0950000000-4d4953250b03650e8e65
Source of Spectrum F2-43-1627-2
Wiley ID 1553131