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(1S*,2R*,6S*)-2-Cyano-9-hydroxy-10-oxotricylo[6.4.0.0(2,6)]dodec-8-ene
SpectraBase Compound ID FrhtU6tC1IR
InChI InChI=1S/C13H15NO2/c14-7-13-5-1-2-8(13)6-9-10(13)3-4-11(15)12(9)16/h8,10,16H,1-6H2/t8-,10+,13+/m0/s1
InChIKey AIKIEKQMPODFKN-IYYTYJHQSA-N
Mol Weight 217.27 g/mol
Molecular Formula C13H15NO2
Exact Mass 217.110279 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4O278bjcrhg
Name (1S*,2R*,6S*)-2-Cyano-9-hydroxy-10-oxotricylo[6.4.0.0(2,6)]dodec-8-ene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15NO2
InChI InChI=1S/C13H15NO2/c14-7-13-5-1-2-8(13)6-9-10(13)3-4-11(15)12(9)16/h8,10,16H,1-6H2/t8-,10+,13+/m0/s1
InChIKey AIKIEKQMPODFKN-IYYTYJHQSA-N
Literature Reference DOI 10.1002/jccs.199700044
Molecular Weight 217.268 g/mol
SMILES OC1=C2C[C@]3([C@@]([C@@]2(CCC1=O)[H])(CCC3)C#N)[H]
SPLASH splash10-00xr-2950000000-3a6f8725acc5a2d949fe
Source of Spectrum QA-44-296-13
Synonyms (3aR,3bS,8aS)-7-hydroxy-6-oxo-2,3,3b,4,5,6,8,8a-octahydrocyclopenta[a]indene-3a(1H)-carbonitrile
Wiley ID 1795060