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3,3,4,4(2H,5H)-Furantetracarbonitrile, 2,5-bis(4-methoxyphenyl)-, cis-
SpectraBase Compound ID BdYBlU00N2S
InChI InChI=1S/C22H16N4O3/c1-27-17-7-3-15(4-8-17)19-21(11-23,12-24)22(13-25,14-26)20(29-19)16-5-9-18(28-2)10-6-16/h3-10,19-20H,1-2H3/t19-,20+
InChIKey NRGZNCZMDBGUKB-BGYRXZFFSA-N
Mol Weight 384.4 g/mol
Molecular Formula C22H16N4O3
Exact Mass 384.12224 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LiSZjKjL28
Name 3,3,4,4(2H,5H)-Furantetracarbonitrile, 2,5-bis(4-methoxyphenyl)-, cis-
Alternate Name(s) (2R,5S)-2,5-bis(4-methoxyphenyl)-3,3,4,4(2H,5H)-furantetracarbonitrile
CAS Registry Number 107245-97-6
Comments Less than 3 mono-isotopic peaks
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Formula C22H16N4O3
InChI InChI=1S/C22H16N4O3/c1-27-17-7-3-15(4-8-17)19-21(11-23,12-24)22(13-25,14-26)20(29-19)16-5-9-18(28-2)10-6-16/h3-10,19-20H,1-2H3/t19-,20+
InChIKey NRGZNCZMDBGUKB-BGYRXZFFSA-N
Molecular Weight 384.395 g/mol
SMILES C1(C([C@](c2ccc(cc2)OC)(O[C@@]1(c1ccc(cc1)OC)[H])[H])(C#N)C#N)(C#N)C#N
SPLASH splash10-000i-0900000000-a5ba9de0bf51c4699e2b
Source of Spectrum C-109-2787-14
Wiley ID 1361597