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(E)-Ethyl 2'-methyl-6-(pyrrolidin-1-yldiazenyl)-[1,1':3',1''-terphenyl]-3-carboxylate
SpectraBase Compound ID 5jMyPR6J3I8
InChI InChI=1S/C26H27N3O2/c1-3-31-26(30)21-14-15-25(27-28-29-16-7-8-17-29)24(18-21)23-13-9-12-22(19(23)2)20-10-5-4-6-11-20/h4-6,9-15,18H,3,7-8,16-17H2,1-2H3/b28-27+
InChIKey LRZFJRADURGJGB-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 GxMwbn4Dk1C
Name (E)-Ethyl 2'-methyl-6-(pyrrolidin-1-yldiazenyl)-[1,1':3',1''-terphenyl]-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H27N3O2
InChI InChI=1S/C26H27N3O2/c1-3-31-26(30)21-14-15-25(27-28-29-16-7-8-17-29)24(18-21)23-13-9-12-22(19(23)2)20-10-5-4-6-11-20/h4-6,9-15,18H,3,7-8,16-17H2,1-2H3/b28-27+
InChIKey LRZFJRADURGJGB-BYYHNAKLSA-N
Literature Reference DOI 10.1021/jo501640d
Molecular Weight 413.521 g/mol
SMILES c1cc(c(-c2cccc(-c3ccccc3)c2C)cc1C(OCC)=O)\N=N\N1CCCC1
SPLASH splash10-00mo-5396000000-ac9b8988a0b4367353cb
Source of Spectrum J-79-9218-3b
Wiley ID 1748241