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(4b.alpha.,8b.beta.,12b.alpha.,16b.beta.)-4b,8b,12b,16b-Tetrazido-4b,8b,12b,16b-tetrahydrodibenzo[a,f]dibenzo[2,3:4,5]pentaleno[1,6-cd]pentalene

View entire compound with spectra: 1 MS (GC)

(4b.alpha.,8b.beta.,12b.alpha.,16b.beta.)-4b,8b,12b,16b-Tetrazido-4b,8b,12b,16b-tetrahydrodibenzo[a,f]dibenzo[2,3:4,5]pentaleno[1,6-cd]pentalene
SpectraBase Compound ID JVOdegZJG9I
InChI InChI=1S/C29H16N12/c30-38-34-25-17-9-1-2-10-18(17)26(35-39-31)21-13-5-6-14-22(21)28(37-41-33)24-16-8-7-15-23(24)27(36-40-32,29(25,26)28)20-12-4-3-11-19(20)25/h1-16H/t25-,26-,27+,28+,29?
InChIKey YTVXMKAHAWSBQY-YEROFDESSA-N
Mol Weight 532.53 g/mol
Molecular Formula C29H16N12
Exact Mass 532.162089 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4ppX8FvCpH5
Name (4b.alpha.,8b.beta.,12b.alpha.,16b.beta.)-4b,8b,12b,16b-Tetrazido-4b,8b,12b,16b-tetrahydrodibenzo[a,f]dibenzo[2,3:4,5]pentaleno[1,6-cd]pentalene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H16N12
InChI InChI=1S/C29H16N12/c30-38-34-25-17-9-1-2-10-18(17)26(35-39-31)21-13-5-6-14-22(21)28(37-41-33)24-16-8-7-15-23(24)27(36-40-32,29(25,26)28)20-12-4-3-11-19(20)25/h1-16H/t25-,26-,27+,28+,29?
InChIKey YTVXMKAHAWSBQY-YEROFDESSA-N
Molecular Weight 532.531 g/mol
SMILES C123[C@]4(c5ccccc5[C@]3(c3ccccc3[C@@]1(c1ccccc1[C@]2(c1ccccc41)N=[N+]=[N-])N=[N+]=[N-])N=[N+]=[N-])N=[N+]=[N-]
SPLASH splash10-0a4l-0002900000-f610a525c7b932c8ce23
Source of Spectrum F-54-5255-16
Synonyms 4b,8b,12b,16b-tetraazido-4b,8b,12b,16b-tetrahydrodibenzo[a,f]dibenzo[2,3:4,5]pentaleno[1,6-cd]pentalene
Wiley ID 806875