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1-(1-adamantyl)-5-chloranyl-4-(2,4,6-tritert-butylphenyl)-1,2,3,4,5-tetrazaphosphole
SpectraBase Compound ID F8w6YmStw9b
InChI InChI=1S/C28H44ClN4P/c1-25(2,3)21-13-22(26(4,5)6)24(23(14-21)27(7,8)9)32-30-31-33(34(32)29)28-15-18-10-19(16-28)12-20(11-18)17-28/h13-14,18-20H,10-12,15-17H2,1-9H3
InChIKey TWQPWUYKRRVZTL-UHFFFAOYSA-N
Mol Weight 503.1 g/mol
Molecular Formula C28H44ClN4P
Exact Mass 502.299212 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AM6opDBnJFF
Name 1-(1-adamantyl)-5-chloranyl-4-(2,4,6-tritert-butylphenyl)-1,2,3,4,5-tetrazaphosphole
CAS Registry Number 129811-67-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H44ClN4P
InChI InChI=1S/C28H44ClN4P/c1-25(2,3)21-13-22(26(4,5)6)24(23(14-21)27(7,8)9)32-30-31-33(34(32)29)28-15-18-10-19(16-28)12-20(11-18)17-28/h13-14,18-20H,10-12,15-17H2,1-9H3
InChIKey TWQPWUYKRRVZTL-UHFFFAOYSA-N
Molecular Weight 503.115 g/mol
SMILES C12(N3P(N(N=N3)c3c(cc(cc3C(C)(C)C)C(C)(C)C)C(C)(C)C)Cl)CC3CC(C2)CC(C1)C3
SPLASH splash10-000i-3900400000-e4ae983708a109add6e5
Source of Spectrum K-123-2331-2
Synonyms 1-(1-adamantyl)-5-chloro-4-(2,4,6-tritert-butylphenyl)tetrazaphosphole
Wiley ID 1399236