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2-Methyl-9-[(E)-2-(2,3,5,6,8,9,11,12-octahydro-1,4,7,10,13-benzopentaoxacyclopentadecin-15-yl)-1-ethenyl][1,10]phenanthroline
SpectraBase Compound ID DG6T4hvl0Eu
InChI InChI=1S/C29H30N2O5/c1-21-2-5-23-6-7-24-8-10-25(31-29(24)28(23)30-21)9-3-22-4-11-26-27(20-22)36-19-17-34-15-13-32-12-14-33-16-18-35-26/h2-11,20H,12-19H2,1H3/b9-3+
InChIKey RSUKZEDQAOUSSY-YCRREMRBSA-N
Mol Weight 486.57 g/mol
Molecular Formula C29H30N2O5
Exact Mass 486.215472 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3dZ1aGT5Ae
Name 2-Methyl-9-[(E)-2-(2,3,5,6,8,9,11,12-octahydro-1,4,7,10,13-benzopentaoxacyclopentadecin-15-yl)-1-ethenyl][1,10]phenanthroline
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Formula C29H30N2O5
InChI InChI=1S/C29H30N2O5/c1-21-2-5-23-6-7-24-8-10-25(31-29(24)28(23)30-21)9-3-22-4-11-26-27(20-22)36-19-17-34-15-13-32-12-14-33-16-18-35-26/h2-11,20H,12-19H2,1H3/b9-3+
InChIKey RSUKZEDQAOUSSY-YCRREMRBSA-N
Instrument Name Finnigan MAT 8430
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0006.f03
Molecular Weight 486.568 g/mol
SMILES c1(\C=C\c2ccc3c(c2)OCCOCCOCCOCCO3)nc2c(cc1)ccc1c2nc(cc1)C
SPLASH splash10-0a4r-9000600000-0c530ea1c36a33bd328a
Source of Spectrum ARK-2005-22-7f
Wiley ID 1870976