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Ethyl 2-[(3-Amino-2,5-dicyano[1,1'-biphenyl]-4-yl)carbonyl]benzoate
SpectraBase Compound ID LaXp1FdSuVF
InChI InChI=1S/C24H17N3O3/c1-2-30-24(29)18-11-7-6-10-17(18)23(28)21-16(13-25)12-19(20(14-26)22(21)27)15-8-4-3-5-9-15/h3-12H,2,27H2,1H3
InChIKey URVMYQQYJPLFLL-UHFFFAOYSA-N
Mol Weight 395.42 g/mol
Molecular Formula C24H17N3O3
Exact Mass 395.126991 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KR5DHRAKK1L
Name Ethyl 2-[(3-Amino-2,5-dicyano[1,1'-biphenyl]-4-yl)carbonyl]benzoate
Alternate Name(s) Ethyl 2-(3-amino-2,5-dicyano-[1,1'-biphenyl]-4-carbonyl)benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H17N3O3
InChI InChI=1S/C24H17N3O3/c1-2-30-24(29)18-11-7-6-10-17(18)23(28)21-16(13-25)12-19(20(14-26)22(21)27)15-8-4-3-5-9-15/h3-12H,2,27H2,1H3
InChIKey URVMYQQYJPLFLL-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hlca.201400287
Molecular Weight 395.418 g/mol
SMILES Nc1c(C(=O)c2c(C(=O)OCC)cccc2)c(cc(c1C#N)-c1ccccc1)C#N
SPLASH splash10-0007-5958000000-efadbebfccaa492fca9a
Source of Spectrum H-98-573-2a
Wiley ID 1786335