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(1R,4S,5R)-1,4-Dicyano-6,6,8,8-tetramethyl-7-oxo-2,3-benzo-bicyclo[3.3.1]nonane

View entire compound with spectra: 1 MS (GC)

(1R,4S,5R)-1,4-Dicyano-6,6,8,8-tetramethyl-7-oxo-2,3-benzo-bicyclo[3.3.1]nonane
SpectraBase Compound ID 7t29SN3nzPI
InChI InChI=1S/C19H20N2O/c1-17(2)15-9-19(11-21,18(3,4)16(17)22)14-8-6-5-7-12(14)13(15)10-20/h5-8,13,15H,9H2,1-4H3/t13-,15-,19-/m1/s1
InChIKey ZQIDKXYHXSRXNQ-ZXYWRSMDSA-N
Mol Weight 292.38 g/mol
Molecular Formula C19H20N2O
Exact Mass 292.157563 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2mcuTi7AotJ
Name (1R,4S,5R)-1,4-Dicyano-6,6,8,8-tetramethyl-7-oxo-2,3-benzo-bicyclo[3.3.1]nonane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H20N2O
InChI InChI=1S/C19H20N2O/c1-17(2)15-9-19(11-21,18(3,4)16(17)22)14-8-6-5-7-12(14)13(15)10-20/h5-8,13,15H,9H2,1-4H3/t13-,15-,19-/m1/s1
InChIKey ZQIDKXYHXSRXNQ-ZXYWRSMDSA-N
Molecular Weight 292.382 g/mol
SMILES [C@]12(C(C(=O)C([C@](C2)([C@](C#N)(c2c1cccc2)[H])[H])(C)C)(C)C)C#N
SPLASH splash10-03di-2900000000-0575bfde4f6ebc6a0644
Source of Spectrum K-2001-58-16
Synonyms (1R,8S,9R)-10,10,12,12-tetramethyl-11-oxotricyclo[7.3.1.0(2,7)]trideca-2,4,6-triene-1,8-dicarbonitrile cis-1,4-Dicyano-6,6,8,8-tetramethyl-7-oxo-2,3-benzo-cis-bicyclo[3.3.1]nonane
Wiley ID 1580270