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4-Acetyl-3-amino-5-phenyl-2,4-cyclopentadiene-1,1,2-tricarbonitrile
SpectraBase Compound ID nwfjWZxFHY
InChI InChI=1S/C16H10N4O/c1-10(21)13-14(11-5-3-2-4-6-11)16(8-18,9-19)12(7-17)15(13)20/h2-6H,20H2,1H3
InChIKey FZCHRHRDTFGMHL-UHFFFAOYSA-N
Mol Weight 274.28 g/mol
Molecular Formula C16H10N4O
Exact Mass 274.085461 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B0iBN1yVscC
Name 4-Acetyl-3-amino-5-phenyl-2,4-cyclopentadiene-1,1,2-tricarbonitrile
CAS Registry Number 300839-26-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H10N4O
InChI InChI=1S/C16H10N4O/c1-10(21)13-14(11-5-3-2-4-6-11)16(8-18,9-19)12(7-17)15(13)20/h2-6H,20H2,1H3
InChIKey FZCHRHRDTFGMHL-UHFFFAOYSA-N
Molecular Weight 274.283 g/mol
SMILES NC1=C(C(C(=C1C(=O)C)c1ccccc1)(C#N)C#N)C#N
SPLASH splash10-0006-9270000000-efd2cd930164ebc938ff
Source of Spectrum AD-0-2532-0
Synonyms 3-Azanyl-4-ethanoyl-5-phenyl-cyclopenta-2,4-diene-1,1,2-tricarbonitrile 4-Acetyl-3-amino-5-phenyl-cyclopenta-2,4-diene-1,1,2-tricarbonitrile Cyclopentadiene-1,5,5-tricarbonitrile, 3-acetyl-2-amino-4-phenyl-
Wiley ID 1431897