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4-{2-[p-(2,3,5,6,8,9,11,12-Octahydro-1,4,7,10,13-pentaoxabenzocyclopentadecen-15-ylethynyl)phenyl]vinyl}-2,2,5,5-tetramethyl-3-imazazoline-3-oxide-1-oxyl
SpectraBase Compound ID 9BIwDe4C2hj
InChI InChI=1S/C31H37N2O7/c1-30(2)29(32(34)31(3,4)33(30)35)14-12-25-7-5-24(6-8-25)9-10-26-11-13-27-28(23-26)40-22-20-38-18-16-36-15-17-37-19-21-39-27/h5-8,11-14,23H,15-22H2,1-4H3/b14-12+
InChIKey ZCRVRQUVIJMLJZ-WYMLVPIESA-N
Mol Weight 550.7 g/mol
Molecular Formula C31H38N2O7
Exact Mass 550.267902 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BTiEOBN8p5O
Name 4-{2-[p-(2,3,5,6,8,9,11,12-Octahydro-1,4,7,10,13-pentaoxabenzocyclopentadecen-15-ylethynyl)phenyl]vinyl}-2,2,5,5-tetramethyl-3-imazazoline-3-oxide-1-oxyl
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H37N2O7
InChI InChI=1S/C31H37N2O7/c1-30(2)29(32(34)31(3,4)33(30)35)14-12-25-7-5-24(6-8-25)9-10-26-11-13-27-28(23-26)40-22-20-38-18-16-36-15-17-37-19-21-39-27/h5-8,11-14,23H,15-22H2,1-4H3/b14-12+
InChIKey ZCRVRQUVIJMLJZ-WYMLVPIESA-N
Molecular Weight 550.652 g/mol
SMILES ON1C([N+](=C(C1(C)C)\C=C\c1ccc(C#Cc2cc3OCCOCCOCCOCCOc3cc2)cc1)[O-])(C)C
SPLASH splash10-0f7k-1410390000-b799b01dfa6d29ef93c1
Source of Spectrum F-62-4602-21
Wiley ID 1633334