For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
5,11,17,23-tetrakis(t-Butyl)-25,26,27,28-tetrakis(allyloxy)-calix[4]arene
SpectraBase Compound ID 5VP7DnNceBs
InChI InChI=1S/C56H72O4/c1-17-21-57-49-37-25-39-31-46(54(8,9)10)33-41(50(39)58-22-18-2)27-43-35-48(56(14,15)16)36-44(52(43)60-24-20-4)28-42-34-47(55(11,12)13)32-40(51(42)59-23-19-3)26-38(49)30-45(29-37)53(5,6)7/h17-20,29-36H,1-4,21-28H2,5-16H3
InChIKey SIVAJLXFQCCNRP-UHFFFAOYSA-N
Mol Weight 809.2 g/mol
Molecular Formula C56H72O4
Exact Mass 808.543061 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 9Ce9ilaAG66
Name 5,11,17,23-tetrakis(t-Butyl)-25,26,27,28-tetrakis(allyloxy)-calix[4]arene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C56H72O4
InChI InChI=1S/C56H72O4/c1-17-21-57-49-37-25-39-31-46(54(8,9)10)33-41(50(39)58-22-18-2)27-43-35-48(56(14,15)16)36-44(52(43)60-24-20-4)28-42-34-47(55(11,12)13)32-40(51(42)59-23-19-3)26-38(49)30-45(29-37)53(5,6)7/h17-20,29-36H,1-4,21-28H2,5-16H3
InChIKey SIVAJLXFQCCNRP-UHFFFAOYSA-N
Molecular Weight 809.188 g/mol
SMILES c12c(c(Cc3c(c(Cc4c(c(Cc5c(c(C2)cc(c5)C(C)(C)C)OCC=C)cc(c4)C(C)(C)C)OCC=C)cc(c3)C(C)(C)C)OCC=C)cc(c1)C(C)(C)C)OCC=C
SPLASH splash10-0a4i-0600000970-61c9ef46e96b3a79f237
Source of Spectrum MN-1998-112-3
Synonyms 5,11,17,23-tetra-tert-butyl-25,26,27,28-tetrakis(prop-2-en-1-yloxy)pentacyclo[19.3.1.1(3,7).1(9,13).1(15,19)]octacosa-1(25),3,5,7(28),9,11,13(27),15(26),16,18,21,23-dodecaene
Wiley ID 1546382