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1,2(trans),2,3(trans),3,4(trans),-1,2-bis(p-cyanophenyl)-3,4-diphenylcyclobutane
SpectraBase Compound ID FQ3zjCuk3kV
InChI InChI=1S/C30H22N2/c31-19-21-11-15-25(16-12-21)29-27(23-7-3-1-4-8-23)28(24-9-5-2-6-10-24)30(29)26-17-13-22(20-32)14-18-26/h1-18,27-30H/t27-,28-,29+,30+/m0/s1
InChIKey KJFQKKSSCSUAQK-VZNYXHRGSA-N
Mol Weight 410.52 g/mol
Molecular Formula C30H22N2
Exact Mass 410.178299 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7agYiGFp7s4
Name 1,2(trans),2,3(trans),3,4(trans),-1,2-bis(p-cyanophenyl)-3,4-diphenylcyclobutane
Alternate Name(s) 4-[(1R,2R,3S,4S)-2-(4-cyanophenyl)-3,4-diphenylcyclobutyl]benzonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H22N2
InChI InChI=1S/C30H22N2/c31-19-21-11-15-25(16-12-21)29-27(23-7-3-1-4-8-23)28(24-9-5-2-6-10-24)30(29)26-17-13-22(20-32)14-18-26/h1-18,27-30H/t27-,28-,29+,30+/m0/s1
InChIKey KJFQKKSSCSUAQK-VZNYXHRGSA-N
Molecular Weight 410.520 g/mol
SMILES [C@]1([C@](c2ccc(C#N)cc2)([C@]([C@@]1(c1ccccc1)[H])(c1ccccc1)[H])[H])(c1ccc(C#N)cc1)[H]
SPLASH splash10-0a4i-0090000000-7901674bdaa06dab3be3
Source of Spectrum J-54-591-6
Wiley ID 1373944