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5,8-Methano-1H-benz[f]isoindole-3a,9a-dicarbonitrile, 2,3,4,5,6,7,8,9-octahydro-1,3-dioxo-, (3a.alpha.,5.alpha.,8.alpha.,9a.alpha.)-
SpectraBase Compound ID GOW6wGDv6zj
InChI InChI=1S/C15H13N3O2/c16-6-14-4-10-8-1-2-9(3-8)11(10)5-15(14,7-17)13(20)18-12(14)19/h8-9H,1-5H2,(H,18,19,20)/t8-,9+,14-,15+
InChIKey LNAAGVQKIIBZLD-NWQDQBDJSA-N
Mol Weight 267.29 g/mol
Molecular Formula C15H13N3O2
Exact Mass 267.100777 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3lHNI8sUA0z
Name 5,8-Methano-1H-benz[f]isoindole-3a,9a-dicarbonitrile, 2,3,4,5,6,7,8,9-octahydro-1,3-dioxo-, (3a.alpha.,5.alpha.,8.alpha.,9a.alpha.)-
CAS Registry Number 108120-78-1
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H13N3O2
InChI InChI=1S/C15H13N3O2/c16-6-14-4-10-8-1-2-9(3-8)11(10)5-15(14,7-17)13(20)18-12(14)19/h8-9H,1-5H2,(H,18,19,20)/t8-,9+,14-,15+
InChIKey LNAAGVQKIIBZLD-NWQDQBDJSA-N
Molecular Weight 267.288 g/mol
SMILES N1C([C@]2([C@@](C1=O)(CC1=C(C2)[C@]2(C[C@@]1(CC2)[H])[H])C#N)C#N)=O
SPLASH splash10-0006-9120000000-0f19f5684924c719d476
Source of Spectrum K-120-1321-7
Synonyms (1R,4R,8S,11S)-5,7-dioxo-6-azatetracyclo[9.2.1.0(2,10).0(4,8)]tetradec-2(10)-ene-4,8-dicarbonitrile
Wiley ID 1271182