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1,4-Ethanonaphthalene-6,6,7,7-tetracarbonitrile, 1,2,3,4,5,8-hexahydro-2,3-bis(methylene)-9-oxo-
SpectraBase Compound ID 9rAQ3Kz05S3
InChI InChI=1S/C18H12N4O/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/h12,16H,1-5H2/t12-,16+/m1/s1
InChIKey JYCBZJWATSCWOP-UHFFFAOYSA-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 3442fYnsLEr
Name 1,4-Ethanonaphthalene-6,6,7,7-tetracarbonitrile, 1,2,3,4,5,8-hexahydro-2,3-bis(methylene)-9-oxo-
CAS Registry Number 87514-97-4
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H12N4O
InChI InChI=1S/C18H12N4O/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/h12,16H,1-5H2/t12-,16+/m1/s1
InChIKey JYCBZJWATSCWOP-UHFFFAOYSA-N
Molecular Weight 300.321 g/mol
SMILES C12=C([C@@]3(C(C([C@]2(CC3=O)[H])=C)=C)[H])CC(C(C1)(C#N)C#N)(C#N)C#N
SPLASH splash10-05q9-0910000000-ec2f5feb509483253e64
Source of Spectrum H-66-1145-0
Synonyms 9,10-dimethylene-11-oxotricyclo[6.2.2.0(2,7)]dodec-2(7)-ene-4,4,5,5-tetracarbonitrile 9,10-Dimethylidene-11-oxotricyclo[6.2.2.0(2,7)]dodec-2(7)-ene-4,4,5,5-tetracarbonitrile
Wiley ID 1302995