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(2E)-2-[1-methyl-6-(4-tetrahydropyran-2-yloxybutyl)-7-oxabicyclo[4.1.0]heptan-2-ylidene]acetonitrile
SpectraBase Compound ID 7WB4TIl6MYn
InChI InChI=1S/C18H27NO3/c1-17-15(9-12-19)7-6-11-18(17,22-17)10-3-5-14-21-16-8-2-4-13-20-16/h9,16H,2-8,10-11,13-14H2,1H3/b15-9+
InChIKey DJSLJTHGZGDYQY-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 IdpF3oSn6o0
Name (2E)-2-[1-methyl-6-(4-tetrahydropyran-2-yloxybutyl)-7-oxabicyclo[4.1.0]heptan-2-ylidene]acetonitrile
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Formula C18H27NO3
InChI InChI=1S/C18H27NO3/c1-17-15(9-12-19)7-6-11-18(17,22-17)10-3-5-14-21-16-8-2-4-13-20-16/h9,16H,2-8,10-11,13-14H2,1H3/b15-9+
InChIKey DJSLJTHGZGDYQY-OQLLNIDSSA-N
Molecular Weight 305.418 g/mol
SMILES C12(OC2(CCC\C1=C\C#N)CCCCOC1OCCCC1)C
SPLASH splash10-000i-9520000000-a6fdd4ea9fd0281097eb
Source of Spectrum F2-43-1625-10
Synonyms (2E)-2-[1-methyl-6-[4-(2-oxanyloxy)butyl]-7-oxabicyclo[4.1.0]heptan-2-ylidene]acetonitrile (2E)-2-[1-methyl-6-[4-(oxan-2-yloxy)butyl]-7-oxabicyclo[4.1.0]heptan-2-ylidene]acetonitrile (2E)-2-[1-methyl-6-[4-(oxan-2-yloxy)butyl]-7-oxabicyclo[4.1.0]heptan-2-ylidene]ethanenitrile
Wiley ID 1553150