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1,4-Ethanonaphthalene-6,6,7,7-tetracarbonitrile, 1,2,3,4,5,8-hexahydro-9-hydroxy-2,3-bis(methylene)-, [1S-(1.alpha.,4.alpha.,9R*)]-

View entire compound with spectra: 1 MS (GC)

1,4-Ethanonaphthalene-6,6,7,7-tetracarbonitrile, 1,2,3,4,5,8-hexahydro-9-hydroxy-2,3-bis(methylene)-, [1S-(1.alpha.,4.alpha.,9R*)]-
SpectraBase Compound ID 9jHy1jsubLD
InChI InChI=1S/C18H14N4O/c1-10-11(2)16-14-5-18(8-21,9-22)17(6-19,7-20)4-13(14)12(10)3-15(16)23/h12,15-16,23H,1-5H2/t12?,15-,16+/m0/s1
InChIKey HABLFACINMWXCH-FFPFEORLSA-N
Mol Weight 302.34 g/mol
Molecular Formula C18H14N4O
Exact Mass 302.116761 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2FtseLKvgl0
Name 1,4-Ethanonaphthalene-6,6,7,7-tetracarbonitrile, 1,2,3,4,5,8-hexahydro-9-hydroxy-2,3-bis(methylene)-, [1S-(1.alpha.,4.alpha.,9R*)]-
CAS Registry Number 87555-16-6
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H14N4O
InChI InChI=1S/C18H14N4O/c1-10-11(2)16-14-5-18(8-21,9-22)17(6-19,7-20)4-13(14)12(10)3-15(16)23/h12,15-16,23H,1-5H2/t12?,15-,16+/m0/s1
InChIKey HABLFACINMWXCH-FFPFEORLSA-N
Molecular Weight 302.337 g/mol
SMILES O[C@]1(CC2C3=C([C@@]1([H])C(C2=C)=C)CC(C(C3)(C#N)C#N)(C#N)C#N)[H]
SPLASH splash10-0a6r-2960000000-81644bdf9ec9e08dc498
Source of Spectrum H-66-1144-0
Synonyms (1R*,11S*)-11-hydroxy-9,10-dimethylidenetricyclo[6.2.2.0(2,7)]dodec-2(7)-ene-4,4,5,5-tetracarbonitrile (1R,11S)-11-hydroxy-9,10-dimethylenetricyclo[6.2.2.0(2,7)]dodec-2(7)-ene-4,4,5,5-tetracarbonitrile
Wiley ID 1304760