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4,5,6,7-Tetracyano-7,8-cyclo-1,2,3,8,9,10,11,12,13,16,17,18-dodecahydro-1,16:9,12-dimethano-2,13-ethano-3,6-ethenoanthracene

View entire compound with spectra: 1 MS (GC)

4,5,6,7-Tetracyano-7,8-cyclo-1,2,3,8,9,10,11,12,13,16,17,18-dodecahydro-1,16:9,12-dimethano-2,13-ethano-3,6-ethenoanthracene
SpectraBase Compound ID 8cc5C4PLGpK
InChI InChI=1S/C24H18N4/c25-8-16-18(9-26)21(10-27)22(11-28)20-7-17-12-1-2-14(5-12)23(17,21)19(16)24(20,22)15-4-3-13(20)6-15/h7,12-15,19H,1-6H2/t12-,13+,14+,15-,19?,20?,21?,22?,23?,24?/m1/s1
InChIKey BRTVHRQNOAUIFU-SIZKOYLDSA-N
Mol Weight 362.44 g/mol
Molecular Formula C24H18N4
Exact Mass 362.153147 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AtUkF4ue5iI
Name 4,5,6,7-Tetracyano-7,8-cyclo-1,2,3,8,9,10,11,12,13,16,17,18-dodecahydro-1,16:9,12-dimethano-2,13-ethano-3,6-ethenoanthracene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H18N4
InChI InChI=1S/C24H18N4/c25-8-16-18(9-26)21(10-27)22(11-28)20-7-17-12-1-2-14(5-12)23(17,21)19(16)24(20,22)15-4-3-13(20)6-15/h7,12-15,19H,1-6H2/t12-,13+,14+,15-,19?,20?,21?,22?,23?,24?/m1/s1
InChIKey BRTVHRQNOAUIFU-SIZKOYLDSA-N
Molecular Weight 362.436 g/mol
SMILES C12(C34C5C6(C2(C(=C5C#N)C#N)C#N)C([C@@]2(CC[C@]6(C2)[H])[H])=CC13[C@@]1(C[C@]4(CC1)[H])[H])C#N
SPLASH splash10-0a50-0009000000-e69911103bf0dcf7e40f
Source of Spectrum QE-5-2128-11
Wiley ID 844309