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1,15-Diazatricyclo[13.13.4.2(29,32)]tetratriaconta-29,31,33-triene, 30,33-dimethoxy-31,34-dioctyl-
SpectraBase Compound ID 81VWWwULLTJ
InChI InChI=1S/C50H92N2O2/c1-5-7-9-11-27-33-39-45-47-50(54-4)46(40-34-28-12-10-8-6-2)48(49(45)53-3)52-43-37-31-25-21-17-13-15-19-23-29-35-41-51(47)42-36-30-24-20-16-14-18-22-26-32-38-44-52/h5-44H2,1-4H3
InChIKey ZXQHCCJTISBJIX-UHFFFAOYSA-N
Mol Weight 753.3 g/mol
Molecular Formula C50H92N2O2
Exact Mass 752.71588 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Aj8ui1NOZO4
Name 1,15-Diazatricyclo[13.13.4.2(29,32)]tetratriaconta-29,31,33-triene, 30,33-dimethoxy-31,34-dioctyl-
CAS Registry Number 77798-85-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C50H92N2O2
InChI InChI=1S/C50H92N2O2/c1-5-7-9-11-27-33-39-45-47-50(54-4)46(40-34-28-12-10-8-6-2)48(49(45)53-3)52-43-37-31-25-21-17-13-15-19-23-29-35-41-51(47)42-36-30-24-20-16-14-18-22-26-32-38-44-52/h5-44H2,1-4H3
InChIKey ZXQHCCJTISBJIX-UHFFFAOYSA-N
Molecular Weight 753.298 g/mol
SMILES c1(c2c(OC)c(c(c1OC)N1CCCCCCCCCCCCCN2CCCCCCCCCCCCC1)CCCCCCCC)CCCCCCCC
SPLASH splash10-0udi-0000000900-df87ec044296fbb71190
Source of Spectrum K-114-888-0
Synonyms 30,33-dimethoxy-31,34-dioctyl-1,15-diazatricyclo[13.13.4.2(29,32)]tetratriaconta-29,31,33-triene 31,34-Dimethoxy-30,33-dioctyl-1,15-diazatricyclo[13.13.4.2(29,32)]tetratriaconta-29,31,33-triene
Wiley ID 1416380