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(E)-6-[4-(Tetrahydro-2-pyranyloxy)pentyl]-7-oxabicyclo[4.1.0]hept-2-ylideneacetonitrile
SpectraBase Compound ID CPuyhxJyM5q
InChI InChI=1S/C18H27NO3/c1-14(21-16-8-2-3-13-20-16)6-4-10-18-11-5-7-15(9-12-19)17(18)22-18/h9,14,16-17H,2-8,10-11,13H2,1H3/b15-9+
InChIKey VPPHOEUMWZNTQS-OQLLNIDSSA-N
Mol Weight 305.42 g/mol
Molecular Formula C18H27NO3
Exact Mass 305.199094 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A35LK4loPVT
Name (E)-6-[4-(Tetrahydro-2-pyranyloxy)pentyl]-7-oxabicyclo[4.1.0]hept-2-ylideneacetonitrile
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Formula C18H27NO3
InChI InChI=1S/C18H27NO3/c1-14(21-16-8-2-3-13-20-16)6-4-10-18-11-5-7-15(9-12-19)17(18)22-18/h9,14,16-17H,2-8,10-11,13H2,1H3/b15-9+
InChIKey VPPHOEUMWZNTQS-OQLLNIDSSA-N
Molecular Weight 305.418 g/mol
SMILES C12(OC1\C(CCC2)=C/C#N)CCCC(OC1OCCCC1)C
SPLASH splash10-000i-9220000000-ef6bec57ebbc30207908
Source of Spectrum F2-43-1625-10
Synonyms (2E)-{6-[4-(tetrahydro-2H-pyran-2-yloxy)pentyl]-7-oxabicyclo[4.1.0]hept-2-ylidene}ethanenitrile (2E)-2-[6-[4-(2-oxanyloxy)pentyl]-7-oxabicyclo[4.1.0]heptan-2-ylidene]acetonitrile (2E)-2-[6-[4-(oxan-2-yloxy)pentyl]-7-oxabicyclo[4.1.0]heptan-2-ylidene]acetonitrile (2E)-2-[6-[4-(oxan-2-yloxy)pentyl]-7-oxabicyclo[4.1.0]heptan-2-ylidene]ethanenitrile
Wiley ID 1553146