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N,N'-bis(2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-trien-17-ylmethyleneamino)pentanediamide
SpectraBase Compound ID qqGON9q4AE
InChI InChI=1S/C35H48N4O12/c40-34(38-36-26-28-4-6-30-32(24-28)50-22-18-46-14-10-42-8-12-44-16-20-48-30)2-1-3-35(41)39-37-27-29-5-7-31-33(25-29)51-23-19-47-15-11-43-9-13-45-17-21-49-31/h4-7,24-27H,1-3,8-23H2,(H,38,40)(H,39,41)
InChIKey VWDDONSMWBJVJU-UHFFFAOYSA-N
Mol Weight 716.8 g/mol
Molecular Formula C35H48N4O12
Exact Mass 716.326873 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3Tkf2t5tmvD
Name N,N'-bis(2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-trien-17-ylmethyleneamino)pentanediamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C35H48N4O12
InChI InChI=1S/C35H48N4O12/c40-34(38-36-26-28-4-6-30-32(24-28)50-22-18-46-14-10-42-8-12-44-16-20-48-30)2-1-3-35(41)39-37-27-29-5-7-31-33(25-29)51-23-19-47-15-11-43-9-13-45-17-21-49-31/h4-7,24-27H,1-3,8-23H2,(H,38,40)(H,39,41)
InChIKey VWDDONSMWBJVJU-UHFFFAOYSA-N
Instrument Name Finnigan SSQ 710
Ionization Type EI
Literature Reference DOI 10.1002_(SICI)1097-0231(19990315)13_5_449
Molecular Weight 716.785 g/mol
SMILES N(N=Cc1cc2c(cc1)OCCOCCOCCOCCO2)C(CCCC(=O)NN=Cc1ccc2c(OCCOCCOCCOCCO2)c1)=O
SPLASH splash10-01t9-0900000000-cabe8483be224bbc69f5
Source of Spectrum RCM-13-449-4
Wiley ID 1836241