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(1R*,2S*,4R*)-4,8,8-Trimethoxy-7-oxobicyclo[2.2.2]oct-5-ene-2-yl cyanide
SpectraBase Compound ID CeaVAr6ZV2L
InChI InChI=1S/C12H15NO4/c1-15-11-5-4-9(8(6-11)7-13)10(14)12(11,16-2)17-3/h4-5,8-9H,6H2,1-3H3/t8-,9-,11+/m1/s1
InChIKey IUXQUQUOQLOVNE-KKZNHRDASA-N
Mol Weight 237.25 g/mol
Molecular Formula C12H15NO4
Exact Mass 237.100108 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3uUxLEjfneb
Name (1R*,2S*,4R*)-4,8,8-Trimethoxy-7-oxobicyclo[2.2.2]oct-5-ene-2-yl cyanide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H15NO4
InChI InChI=1S/C12H15NO4/c1-15-11-5-4-9(8(6-11)7-13)10(14)12(11,16-2)17-3/h4-5,8-9H,6H2,1-3H3/t8-,9-,11+/m1/s1
InChIKey IUXQUQUOQLOVNE-KKZNHRDASA-N
Molecular Weight 237.255 g/mol
SMILES C1([C@@]2(C=C[C@@](C1=O)([C@@](C#N)(C2)[H])[H])OC)(OC)OC
SPLASH splash10-08i0-2920000000-8e2dde7ca7304501485e
Source of Spectrum F-59-4043-3i
Wiley ID 1678077