5,11,17,23-Tetrakis(N'-benzyl-N-piperazino-methyl)-25,26,27,28-tetrahydroxy-calix(4)arene

SpectraBase Compound ID	9AgsfGZsisr
InChI	InChI=1S/C76H88N8O4/c85-73-65-37-61(53-81-29-21-77(22-30-81)49-57-13-5-1-6-14-57)38-66(73)46-68-40-63(55-83-33-25-79(26-34-83)51-59-17-9-3-10-18-59)42-70(75(68)87)48-72-44-64(56-84-35-27-80(28-36-84)52-60-19-11-4-12-20-60)43-71(76(72)88)47-69-41-62(39-67(45-65)74(69)86)54-82-31-23-78(24-32-82)50-58-15-7-2-8-16-58/h1-20,37-44,85-88H,21-36,45-56H2
InChIKey	YCBJWBOLSFGVIF-UHFFFAOYSA-N Google Search
Mol Weight	1177.6 g/mol
Molecular Formula	C76H88N8O4
Exact Mass	1176.692853 g/mol

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SpectraBase Spectrum ID	EkqEcyOwGmY
Name	5,11,17,23-Tetrakis(N'-benzyl-N-piperazino-methyl)-25,26,27,28-tetrahydroxy-calix(4)arene
Copyright	Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula	C76H88N8O4
InChI	InChI=1S/C76H88N8O4/c85-73-65-37-61(53-81-29-21-77(22-30-81)49-57-13-5-1-6-14-57)38-66(73)46-68-40-63(55-83-33-25-79(26-34-83)51-59-17-9-3-10-18-59)42-70(75(68)87)48-72-44-64(56-84-35-27-80(28-36-84)52-60-19-11-4-12-20-60)43-71(76(72)88)47-69-41-62(39-67(45-65)74(69)86)54-82-31-23-78(24-32-82)50-58-15-7-2-8-16-58/h1-20,37-44,85-88H,21-36,45-56H2
InChIKey	YCBJWBOLSFGVIF-UHFFFAOYSA-N
Instrument Name	Varian XL-300
Literature Reference	C.D. Gutsche, K.C.Nam, J. Am. Chem. Soc. 110, 6153 (1988).
NMR Standard	TMS
Origin	Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent	CDCl3