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2-Amino-1-(4-fluorobenzyl)-4,5-bis(4-methoxyphenyl)pyrrole-3-carbonitrile
SpectraBase Compound ID I7m62SuGJSH
InChI InChI=1S/C26H22FN3O2/c1-31-21-11-5-18(6-12-21)24-23(15-28)26(29)30(16-17-3-9-20(27)10-4-17)25(24)19-7-13-22(32-2)14-8-19/h3-14H,16,29H2,1-2H3
InChIKey ZTRPNADGQKSKRV-UHFFFAOYSA-N
Mol Weight 427.48 g/mol
Molecular Formula C26H22FN3O2
Exact Mass 427.169605 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KtITZGuetif
Name 2-Amino-1-(4-fluorobenzyl)-4,5-bis(4-methoxyphenyl)pyrrole-3-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H22FN3O2
InChI InChI=1S/C26H22FN3O2/c1-31-21-11-5-18(6-12-21)24-23(15-28)26(29)30(16-17-3-9-20(27)10-4-17)25(24)19-7-13-22(32-2)14-8-19/h3-14H,16,29H2,1-2H3
InChIKey ZTRPNADGQKSKRV-UHFFFAOYSA-N
Molecular Weight 427.479 g/mol
SMILES Nc1[n](Cc2ccc(cc2)F)c(c(c1C#N)-c1ccc(cc1)OC)-c1ccc(cc1)OC
SPLASH splash10-014i-2549100000-2c988c0fbe349ad74dbb
Synonyms 2-Amino-1-[(4-fluorophenyl)methyl]-4,5-bis(4-methoxyphenyl)-3-pyrrolecarbonitrile 2-Amino-1-[(4-fluorophenyl)methyl]-4,5-bis(4-methoxyphenyl)pyrrole-3-carbonitrile 2-Azanyl-1-[(4-fluorophenyl)methyl]-4,5-bis(4-methoxyphenyl)pyrrole-3-carbonitrile
Wiley ID 1444538