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1-Amino-2,5,5-tricyano-3,4-bis[p-(trifluoromethyl)phenyl]cyclopent-1-ene
SpectraBase Compound ID 2NUR2JwUu9K
InChI InChI=1S/C22H12F6N4/c23-21(24,25)14-5-1-12(2-6-14)17-16(9-29)19(32)20(10-30,11-31)18(17)13-3-7-15(8-4-13)22(26,27)28/h1-8,17-18H,32H2
InChIKey ABSSYSCCDKBDBO-UHFFFAOYSA-N
Mol Weight 446.36 g/mol
Molecular Formula C22H12F6N4
Exact Mass 446.096615 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BIRkVtMJ7EM
Name 1-Amino-2,5,5-tricyano-3,4-bis[p-(trifluoromethyl)phenyl]cyclopent-1-ene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H12F6N4
InChI InChI=1S/C22H12F6N4/c23-21(24,25)14-5-1-12(2-6-14)17-16(9-29)19(32)20(10-30,11-31)18(17)13-3-7-15(8-4-13)22(26,27)28/h1-8,17-18H,32H2
InChIKey ABSSYSCCDKBDBO-UHFFFAOYSA-N
Molecular Weight 446.356 g/mol
SMILES NC1=C(C#N)C(C(C1(C#N)C#N)c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cc1
SPLASH splash10-0002-1202900000-a20a84b5297f29dc05d3
Source of Spectrum SK-28-3275-2
Synonyms cis and trans-2-Amino-1,3,3-tricyano-4,5-di(4-trifluorophenyl)cyclopentene 2-Amino-4,5-bis[4-(trifluoromethyl)phenyl]-2-cyclopentene-1,1,3-tricarbonitrile
Wiley ID 868591