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5H,23H,17H,36H-15,16,33,34-tetrahydrotetrabenzo[b,i,p,w][1,11,15,25,4,5,7,8,18,19,21,22]tetraoxaoctaazacyclooctacosine-7,25-dicarbonitrile

View entire compound with spectra: 1 MS (GC)

5H,23H,17H,36H-15,16,33,34-tetrahydrotetrabenzo[b,i,p,w][1,11,15,25,4,5,7,8,18,19,21,22]tetraoxaoctaazacyclooctacosine-7,25-dicarbonitrile
SpectraBase Compound ID Ibg0dS5lDgW
InChI InChI=1S/C34H30N10O4/c35-23-33-41-37-25-11-1-5-15-29(25)45-19-9-20-46-31-17-7-3-13-27(31)39-43-34(24-36)44-40-28-14-4-8-18-32(28)48-22-10-21-47-30-16-6-2-12-26(30)38-42-33/h1-8,11-18,37,40H,9-10,19-22H2/b41-33-,42-38-,43-39-,44-34-
InChIKey XBFDIGFTLXVAHY-MXTQQVHOSA-N
Mol Weight 642.7 g/mol
Molecular Formula C34H30N10O4
Exact Mass 642.245149 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3lLFLawdHs
Name 5H,23H,17H,36H-15,16,33,34-tetrahydrotetrabenzo[b,i,p,w][1,11,15,25,4,5,7,8,18,19,21,22]tetraoxaoctaazacyclooctacosine-7,25-dicarbonitrile
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Formula C34H30N10O4
InChI InChI=1S/C34H30N10O4/c35-23-33-41-37-25-11-1-5-15-29(25)45-19-9-20-46-31-17-7-3-13-27(31)39-43-34(24-36)44-40-28-14-4-8-18-32(28)48-22-10-21-47-30-16-6-2-12-26(30)38-42-33/h1-8,11-18,37,40H,9-10,19-22H2/b41-33-,42-38-,43-39-,44-34-
InChIKey XBFDIGFTLXVAHY-MXTQQVHOSA-N
Molecular Weight 642.680 g/mol
SMILES N1c2c(OCCCOc3c(\N=N/C(=N\Nc4c(OCCCOc5c(\N=N/C(C#N)=N/1)cccc5)cccc4)C#N)cccc3)cccc2
SPLASH splash10-01dm-9400000000-7e18960f5f5ce1629c5e
Source of Spectrum F-54-12425-4
Synonyms 16,17,34,35-tetrahydro-5H,15H,23H,33H-tetrabenzo[b,i,p,w][1,11,15,25,4,5,7,8,18,19,21,22]tetraoxaoctaazacyclooctacosine-7,25-dicarbonitrile
Wiley ID 809188