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2-Amino-1,3,3-tricyano-4,5-bis(3,4-methylenedioxyphenyl)cyclopentene
SpectraBase Compound ID FBI8q2YTXo0
InChI InChI=1S/C22H14N4O4/c23-7-14-19(12-1-3-15-17(5-12)29-10-27-15)20(22(8-24,9-25)21(14)26)13-2-4-16-18(6-13)30-11-28-16/h1-6,19-20H,10-11,26H2/t19-,20+/m0/s1
InChIKey YEAHYJGZXIJYIS-VQTJNVASSA-N
Mol Weight 398.38 g/mol
Molecular Formula C22H14N4O4
Exact Mass 398.101505 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2ErjLu86rXS
Name 2-Amino-1,3,3-tricyano-4,5-bis(3,4-methylenedioxyphenyl)cyclopentene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H14N4O4
InChI InChI=1S/C22H14N4O4/c23-7-14-19(12-1-3-15-17(5-12)29-10-27-15)20(22(8-24,9-25)21(14)26)13-2-4-16-18(6-13)30-11-28-16/h1-6,19-20H,10-11,26H2/t19-,20+/m0/s1
InChIKey YEAHYJGZXIJYIS-VQTJNVASSA-N
Molecular Weight 398.378 g/mol
SMILES NC1=C(C#N)[C@@]([C@](C1(C#N)C#N)(c1cc2OCOc2cc1)[H])(c1cc2OCOc2cc1)[H]
SPLASH splash10-0002-0409000000-80576ac5cc1194b61969
Source of Spectrum KC-0-2400-2
Synonyms (4S,5S)-2-Amino-4,5-bis-benzo[1,3]dioxol-5-yl-cyclopent-2-ene-1,1,3-tricarbonitrile 2-Amino-4,5-di(1,3-benzodioxol-5-yl)-2-cyclopentene-1,1,3-tricarbonitrile (4S,5S)-2-azanyl-4,5-bis(1,3-benzodioxol-5-yl)cyclopent-2-ene-1,1,3-tricarbonitrile
Wiley ID 825829