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2,11,13,22,23,25-HEXAOXA-1,12(1,3,2)-DIBENZENA-24(2,9)-1,10-PHENANTHROLINABICYCLO-[10.10.3]-PENTACOSAPHANE
SpectraBase Compound ID 1EE6quuiJUr
InChI InChI=1S/C40H44N2O6/c1-2-6-10-26-44-32-16-14-18-34-40(32)48-36-24-22-30-20-19-29-21-23-35(41-37(29)38(30)42-36)47-39-31(43-25-9-5-1)15-13-17-33(39)45-27-11-7-3-4-8-12-28-46-34/h13-24H,1-12,25-28H2
InChIKey WFGWPHXBWLWWCL-UHFFFAOYSA-N
Mol Weight 648.8 g/mol
Molecular Formula C40H44N2O6
Exact Mass 648.319937 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gy1vacfiFH3
Name 2,11,13,22,23,25-Hexaoxa-1,12(1,3,2)-dibenza-24(2,9)-1,10-phenanthrolinabicyclo[10.10.3]pentacosaphane
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C40H44N2O6
InChI InChI=1S/C40H44N2O6/c1-2-6-10-26-44-32-16-14-18-34-40(32)48-36-24-22-30-20-19-29-21-23-35(41-37(29)38(30)42-36)47-39-31(43-25-9-5-1)15-13-17-33(39)45-27-11-7-3-4-8-12-28-46-34/h13-24H,1-12,25-28H2
InChIKey WFGWPHXBWLWWCL-UHFFFAOYSA-N
Molecular Weight 648.800 g/mol
SMILES c12Oc3nc4c5nc(Oc6c7cccc6OCCCCCCCCOc1cccc2OCCCCCCCCO7)ccc5ccc4cc3
SPLASH splash10-0002-0000009000-4d49c1e3a71431c36644
Source of Spectrum K1-0-923-19
Wiley ID 1588391