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N,N'-bis(2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-trien-17-ylmethyleneamino)hexanediamide
SpectraBase Compound ID 3ALzjCGSDlr
InChI InChI=1S/C36H50N4O12/c41-35(39-37-27-29-5-7-31-33(25-29)51-23-19-47-15-11-43-9-13-45-17-21-49-31)3-1-2-4-36(42)40-38-28-30-6-8-32-34(26-30)52-24-20-48-16-12-44-10-14-46-18-22-50-32/h5-8,25-28H,1-4,9-24H2,(H,39,41)(H,40,42)
InChIKey JHPSUXLJXRJEJQ-UHFFFAOYSA-N
Mol Weight 730.8 g/mol
Molecular Formula C36H50N4O12
Exact Mass 730.342523 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 29HZyqnJm3Y
Name N,N'-bis(2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-trien-17-ylmethyleneamino)hexanediamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H50N4O12
InChI InChI=1S/C36H50N4O12/c41-35(39-37-27-29-5-7-31-33(25-29)51-23-19-47-15-11-43-9-13-45-17-21-49-31)3-1-2-4-36(42)40-38-28-30-6-8-32-34(26-30)52-24-20-48-16-12-44-10-14-46-18-22-50-32/h5-8,25-28H,1-4,9-24H2,(H,39,41)(H,40,42)
InChIKey JHPSUXLJXRJEJQ-UHFFFAOYSA-N
Instrument Name Finnigan SSQ 710
Ionization Type EI
Literature Reference DOI 10.1002_(SICI)1097-0231(19990315)13_5_449
Molecular Weight 730.812 g/mol
SMILES N(N=Cc1cc2c(cc1)OCCOCCOCCOCCO2)C(CCCCC(=O)NN=Cc1ccc2c(OCCOCCOCCOCCO2)c1)=O
SPLASH splash10-03di-0900000000-1e9f8cce7f5e13f3283d
Source of Spectrum RCM-13-449-5
Wiley ID 1836242