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3,3,4,4(2H,5H)-Furantetracarbonitrile, 2-(4-methoxyphenyl)-5-phenyl-, trans-
SpectraBase Compound ID Ek47QoC4cKz
InChI InChI=1S/C21H14N4O2/c1-26-17-9-7-16(8-10-17)19-21(13-24,14-25)20(11-22,12-23)18(27-19)15-5-3-2-4-6-15/h2-10,18-19H,1H3/t18-,19-/m1/s1
InChIKey UXJJKVUSSKTFIW-RTBURBONSA-N
Mol Weight 354.37 g/mol
Molecular Formula C21H14N4O2
Exact Mass 354.111676 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DgcjvdEp7VJ
Name 3,3,4,4(2H,5H)-Furantetracarbonitrile, 2-(4-methoxyphenyl)-5-phenyl-, trans-
CAS Registry Number 107246-02-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H14N4O2
InChI InChI=1S/C21H14N4O2/c1-26-17-9-7-16(8-10-17)19-21(13-24,14-25)20(11-22,12-23)18(27-19)15-5-3-2-4-6-15/h2-10,18-19H,1H3/t18-,19-/m1/s1
InChIKey UXJJKVUSSKTFIW-RTBURBONSA-N
Molecular Weight 354.369 g/mol
SMILES C1(C([C@@](c2ccccc2)(O[C@@]1(c1ccc(cc1)OC)[H])[H])(C#N)C#N)(C#N)C#N
SPLASH splash10-004i-0900000000-36f4a1a5e5c58bc5c3cf
Source of Spectrum C-109-2787-15
Synonyms (2R,5R)-2-(4-methoxyphenyl)-5-phenyl-3,3,4,4(2H,5H)-furantetracarbonitrile
Wiley ID 1344655