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1,4-Methanonaphthalene-6,6,7,7-tetracarbonitrile, 1,2,3,4,5,8-hexahydro-9-hydroxy-2,3-bis(methylene)-9-(1-methylethenyl)-, stereoisomer
SpectraBase Compound ID HmfXXrkPr60
InChI InChI=1S/C20H16N4O/c1-11(2)20(25)16-12(3)13(4)17(20)15-6-19(9-23,10-24)18(7-21,8-22)5-14(15)16/h16-17,25H,1,3-6H2,2H3/t16-,17+,20+
InChIKey VTBBYEWHYHVNEV-UHFFFAOYSA-N
Mol Weight 328.38 g/mol
Molecular Formula C20H16N4O
Exact Mass 328.132411 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1mxIRPqc1Rq
Name 1,4-Methanonaphthalene-6,6,7,7-tetracarbonitrile, 1,2,3,4,5,8-hexahydro-9-hydroxy-2,3-bis(methylene)-9-(1-methylethenyl)-, stereoisomer
CAS Registry Number 120663-22-1
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H16N4O
InChI InChI=1S/C20H16N4O/c1-11(2)20(25)16-12(3)13(4)17(20)15-6-19(9-23,10-24)18(7-21,8-22)5-14(15)16/h16-17,25H,1,3-6H2,2H3/t16-,17+,20+
InChIKey VTBBYEWHYHVNEV-UHFFFAOYSA-N
Molecular Weight 328.375 g/mol
SMILES O[C@]1([C@@]2(C3=C([C@]1(C(C2=C)=C)[H])CC(C(C3)(C#N)C#N)(C#N)C#N)[H])C(=C)C
SPLASH splash10-0w4j-9100000000-b4a0b174163c5274601c
Source of Spectrum H-71-1279-34
Synonyms 11-syn-hydroxy-9,10-dimethylidene-11-(propen-2'-yl)tricyclo[6.2.1.0(2,7)]undec-2(7)-ene-4,4,5,5-tetracarbonitrile 11-anti-hydroxy-9,10-dimethylidene-11-(propen-2'-yl)tricyclo[6.2.1.0(2,7)]undec-2(7)-ene-4,4,5,5-tetracarbonitrile 11-hydroxy-11-isopropenyl-9,10-dimethylenetricyclo[6.2.1.0(2,7)]undec-2(7)-ene-4,4,5,5-tetracarbonitrile
Wiley ID 1326461