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(E)-(1R,5S,7S)-ETHYL-7-ETHOXY-8-OXABICYCLO-[3.2.1]-OCTAN-2-YLIDENE-CYANO-ACETATE
SpectraBase Compound ID HuUv0mKLfF7
InChI InChI=1S/C14H19NO4/c1-3-17-12-7-9-5-6-10(13(12)19-9)11(8-15)14(16)18-4-2/h9,12-13H,3-7H2,1-2H3/b11-10+/t9-,12-,13+/m0/s1
InChIKey KTYYRGMYDVHEJI-PJWHRNDWSA-N
Mol Weight 265.31 g/mol
Molecular Formula C14H19NO4
Exact Mass 265.131408 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4pITUnbN4Oq
Name (2E)-2-cyano-2-[(1S,5R,6S)-6-ethoxy-8-oxabicyclo[3.2.1]octan-4-ylidene]acetic acid ethyl ester
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Formula C14H19NO4
InChI InChI=1S/C14H19NO4/c1-3-17-12-7-9-5-6-10(13(12)19-9)11(8-15)14(16)18-4-2/h9,12-13H,3-7H2,1-2H3/b11-10+/t9-,12-,13+/m0/s1
InChIKey KTYYRGMYDVHEJI-PJWHRNDWSA-N
Molecular Weight 265.309 g/mol
SMILES [C@]12(\C(=C\(C(=O)OCC)C#N)CC[C@@](O2)([H])C[C@@]1(OCC)[H])[H]
SPLASH splash10-0006-1900000000-3724abe60582c5519049
Source of Spectrum H1-51-2156-21
Synonyms Ethyl (2E)-2-cyano-2-[(1S,5R,6S)-6-ethoxy-8-oxabicyclo[3.2.1]octan-4-ylidene]acetate Ethyl (2E)-2-cyano-2-[(1S,5R,6S)-6-ethoxy-8-oxabicyclo[3.2.1]octan-4-ylidene]ethanoate
Wiley ID 817254