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Ethyl (E)-5''-methyl-2''-(pyrrolidin-1-yldiazenyl)-[1,1':2',1''-terphenyl]-4-carboxylate
SpectraBase Compound ID 3pjfeGaghaK
InChI InChI=1S/C26H27N3O2/c1-3-31-26(30)21-13-11-20(12-14-21)22-8-4-5-9-23(22)24-18-19(2)10-15-25(24)27-28-29-16-6-7-17-29/h4-5,8-15,18H,3,6-7,16-17H2,1-2H3/b28-27+
InChIKey CNXHVMKQKXJCOX-BYYHNAKLSA-N
Mol Weight 413.52 g/mol
Molecular Formula C26H27N3O2
Exact Mass 413.210327 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G5oCAXMVOoQ
Name Ethyl (E)-5''-methyl-2''-(pyrrolidin-1-yldiazenyl)-[1,1':2',1''-terphenyl]-4-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H27N3O2
InChI InChI=1S/C26H27N3O2/c1-3-31-26(30)21-13-11-20(12-14-21)22-8-4-5-9-23(22)24-18-19(2)10-15-25(24)27-28-29-16-6-7-17-29/h4-5,8-15,18H,3,6-7,16-17H2,1-2H3/b28-27+
InChIKey CNXHVMKQKXJCOX-BYYHNAKLSA-N
Molecular Weight 413.521 g/mol
SMILES c1cc(c(-c2cc(ccc2\N=N\N2CCCC2)C)cc1)-c1ccc(C(OCC)=O)cc1
SPLASH splash10-002f-0091100000-c333990fff9498a3f917
Source of Spectrum ACI-51-SMS-8-1c
Wiley ID 1780853