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(1a.alpha.,2.alpha.,7.alpha.,7a.alpha.)-1a,2,3,6,7,7a-Hexahydro-8,9-bis(methylene)-2,7-ethanonaphth[2,3-b]oxirene-4,4,5,5-tetracarbonitrile

View entire compound with spectra: 1 MS (GC)

(1a.alpha.,2.alpha.,7.alpha.,7a.alpha.)-1a,2,3,6,7,7a-Hexahydro-8,9-bis(methylene)-2,7-ethanonaphth[2,3-b]oxirene-4,4,5,5-tetracarbonitrile
SpectraBase Compound ID CcwuHxxPFJn
InChI InChI=1S/C18H12N4O/c1-9-10(2)14-12-4-18(7-21,8-22)17(5-19,6-20)3-11(12)13(9)15-16(14)23-15/h13-16H,1-4H2/t13-,14+,15+,16-
InChIKey IXSMBCLXDLXIOZ-SYMSYNOKSA-N
Mol Weight 300.32 g/mol
Molecular Formula C18H12N4O
Exact Mass 300.101111 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6CGFCHRxxnL
Name (1a.alpha.,2.alpha.,7.alpha.,7a.alpha.)-1a,2,3,6,7,7a-Hexahydro-8,9-bis(methylene)-2,7-ethanonaphth[2,3-b]oxirene-4,4,5,5-tetracarbonitrile
CAS Registry Number 75073-81-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H12N4O
InChI InChI=1S/C18H12N4O/c1-9-10(2)14-12-4-18(7-21,8-22)17(5-19,6-20)3-11(12)13(9)15-16(14)23-15/h13-16H,1-4H2/t13-,14+,15+,16-
InChIKey IXSMBCLXDLXIOZ-SYMSYNOKSA-N
Molecular Weight 300.321 g/mol
SMILES [C@]12([C@@]([C@@]3([H])C4=C([C@@]2(C(C3=C)=C)[H])CC(C(C#N)(C#N)C4)(C#N)C#N)([H])O1)[H]
SPLASH splash10-004i-0920000000-d650622ab19f157646ac
Source of Spectrum F-36-153-0
Synonyms (1R,8S,9R,11S)-12,13-dimethylene-10-oxatetracyclo[6.3.2.0(2,7).0(9,11)]tridec-2(7)-ene-4,4,5,5-tetracarbonitrile
Wiley ID 1302994