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3,3,4,4(2H,5H)-Furantetracarbonitrile, 2,5-bis(4-methylphenyl)-, cis-
SpectraBase Compound ID 45DGGfxEk73
InChI InChI=1S/C22H16N4O/c1-15-3-7-17(8-4-15)19-21(11-23,12-24)22(13-25,14-26)20(27-19)18-9-5-16(2)6-10-18/h3-10,19-20H,1-2H3/t19-,20+
InChIKey QXQVTFYQXMYCSV-BGYRXZFFSA-N
Mol Weight 352.4 g/mol
Molecular Formula C22H16N4O
Exact Mass 352.132411 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DTKR8EkUyF8
Name 3,3,4,4(2H,5H)-Furantetracarbonitrile, 2,5-bis(4-methylphenyl)-, cis-
Alternate Name(s) (2R,5S)-2,5-bis(4-methylphenyl)-3,3,4,4(2H,5H)-furantetracarbonitrile
CAS Registry Number 107246-09-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H16N4O
InChI InChI=1S/C22H16N4O/c1-15-3-7-17(8-4-15)19-21(11-23,12-24)22(13-25,14-26)20(27-19)18-9-5-16(2)6-10-18/h3-10,19-20H,1-2H3/t19-,20+
InChIKey QXQVTFYQXMYCSV-BGYRXZFFSA-N
Molecular Weight 352.397 g/mol
SMILES C1(C([C@](c2ccc(cc2)C)(O[C@@]1(c1ccc(cc1)C)[H])[H])(C#N)C#N)(C#N)C#N
SPLASH splash10-00di-0690000000-bd715eb99b4c49e32060
Source of Spectrum C-109-2787-14
Wiley ID 1343552