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11,23-bis(Ethoxymethyl)-25,27-dihydroxy-26,28-dimethoxy-calix[4]arene
SpectraBase Compound ID 8JSCVMONQTd
InChI InChI=1S/C36H40O6/c1-5-41-21-23-13-29-17-25-9-7-11-27(35(25)39-3)19-31-15-24(22-42-6-2)16-32(34(31)38)20-28-12-8-10-26(36(28)40-4)18-30(14-23)33(29)37/h7-16,37-38H,5-6,17-22H2,1-4H3
InChIKey HOBLZMVZCYZGQM-UHFFFAOYSA-N
Mol Weight 568.7 g/mol
Molecular Formula C36H40O6
Exact Mass 568.282489 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DX7a3fzsiV1
Name 11,23-bis(Ethoxymethyl)-25,27-dihydroxy-26,28-dimethoxy-calix[4]arene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H40O6
InChI InChI=1S/C36H40O6/c1-5-41-21-23-13-29-17-25-9-7-11-27(35(25)39-3)19-31-15-24(22-42-6-2)16-32(34(31)38)20-28-12-8-10-26(36(28)40-4)18-30(14-23)33(29)37/h7-16,37-38H,5-6,17-22H2,1-4H3
InChIKey HOBLZMVZCYZGQM-UHFFFAOYSA-N
Molecular Weight 568.710 g/mol
SMILES Oc1c2Cc3c(c(Cc4c(c(Cc5c(c(Cc1cc(c2)COCC)ccc5)OC)cc(c4)COCC)O)ccc3)OC
SPLASH splash10-00di-0310490000-8bde1b30ef0f7b32edaf
Source of Spectrum SK-25-1115-6
Synonyms 11,23-bis(ethoxymethyl)-26,28-dimethoxypentacyclo[19.3.1.1(3,7).1(9,13).1(15,19)]octacosa-1(25),3(28),4,6,9(27),10,12,15(26),16,18,21,23-dodecaene-25,27-diol
Wiley ID 866613