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1,3,5,7-tetrakis(4-tert-butylphenyl)-1,3,5,7-tetrazocane
SpectraBase Compound ID 6bqq2XTTZUB
InChI InChI=1S/C44H60N4/c1-41(2,3)33-13-21-37(22-14-33)45-29-46(38-23-15-34(16-24-38)42(4,5)6)31-48(40-27-19-36(20-28-40)44(10,11)12)32-47(30-45)39-25-17-35(18-26-39)43(7,8)9/h13-28H,29-32H2,1-12H3
InChIKey WVIDOACRVDMTPH-UHFFFAOYSA-N
Mol Weight 645.0 g/mol
Molecular Formula C44H60N4
Exact Mass 644.481798 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LWjFrA97YBs
Name 1,3,5,7-tetrakis(4-tert-butylphenyl)-1,3,5,7-tetrazocane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C44H60N4
InChI InChI=1S/C44H60N4/c1-41(2,3)33-13-21-37(22-14-33)45-29-46(38-23-15-34(16-24-38)42(4,5)6)31-48(40-27-19-36(20-28-40)44(10,11)12)32-47(30-45)39-25-17-35(18-26-39)43(7,8)9/h13-28H,29-32H2,1-12H3
InChIKey WVIDOACRVDMTPH-UHFFFAOYSA-N
Literature Reference DOI 10.1002/prac.19873290619
Molecular Weight 644.992 g/mol
SMILES C1N(CN(c2ccc(cc2)C(C)(C)C)CN(CN1c1ccc(cc1)C(C)(C)C)c1ccc(C(C)(C)C)cc1)c1ccc(cc1)C(C)(C)C
SPLASH splash10-01ot-1900000000-326e166d0a81e962491e
Source of Spectrum JF-329-1094-3d
Synonyms 1,3,5,7-tetrakis(4-(tert-butyl)phenyl)-1,3,5,7-tetrazocane
Wiley ID 1791613