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6,15,33,42-Tetraoxa-43,46-diazaheptacyclo[18.12.10.4(22,31).0(5,32).0(16,21).0(25,45).0(28,44)]hexatetraconta-1,3,5(32),16,18,20,22,24,26,28,30,43,45-tridecaene
SpectraBase Compound ID 7vLXer8ewws
InChI InChI=1S/C40H44N2O4/c1-2-6-10-26-44-34-16-14-18-36-38(34)32-24-22-30-20-19-29-21-23-31(41-39(29)40(30)42-32)37-33(43-25-9-5-1)15-13-17-35(37)45-27-11-7-3-4-8-12-28-46-36/h13-24H,1-12,25-28H2
InChIKey AEWZHPVXPKHCLJ-UHFFFAOYSA-N
Mol Weight 616.8 g/mol
Molecular Formula C40H44N2O4
Exact Mass 616.330108 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FPzVGplkyMv
Name 6,15,33,42-Tetraoxa-43,46-diazaheptacyclo[18.12.10.4(22,31).0(5,32).0(16,21).0(25,45).0(28,44)]hexatetraconta-1,3,5(32),16,18,20,22,24,26,28,30,43,45-tridecaene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C40H44N2O4
InChI InChI=1S/C40H44N2O4/c1-2-6-10-26-44-34-16-14-18-36-38(34)32-24-22-30-20-19-29-21-23-31(41-39(29)40(30)42-32)37-33(43-25-9-5-1)15-13-17-35(37)45-27-11-7-3-4-8-12-28-46-36/h13-24H,1-12,25-28H2
InChIKey AEWZHPVXPKHCLJ-UHFFFAOYSA-N
Molecular Weight 616.802 g/mol
SMILES c1-2nc3c4nc(-c5c6OCCCCCCCCOc7c2c(OCCCCCCCCOc5ccc6)ccc7)ccc4ccc3cc1
SPLASH splash10-0006-9000002000-ba116d4267a20b5318ac
Source of Spectrum K-127-2302-1
Synonyms 2,11,13,22-Tetraoxa-1,12(1,3,2)-dibenzena-23(2,9)-1,10-phenanthrolinabicyclo[10,10,1]tricosaphane 6,15,33,42-tetraoxa-43,46-diazaheptacyclo[18.12.10.4(22,31).0(5,32).0(16,21).0(25,45).0(28,44)]hexatetraconta-1(32),2,4,16,18,20,22,24,26,28,30,43,45-tridecaene
Wiley ID 1411345