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5,11,17,23-Tetracyclohexyl-25,26,27,28-tetrahydroxycalix[4]arene
SpectraBase Compound ID 1Bil4Fc2yWu
InChI InChI=1S/C52H64O4/c53-49-41-21-37(33-13-5-1-6-14-33)22-42(49)30-44-24-39(35-17-9-3-10-18-35)26-46(51(44)55)32-48-28-40(36-19-11-4-12-20-36)27-47(52(48)56)31-45-25-38(23-43(29-41)50(45)54)34-15-7-2-8-16-34/h21-28,33-36,53-56H,1-20,29-32H2
InChIKey IOTOUYIHSSCOII-UHFFFAOYSA-N
Mol Weight 753.1 g/mol
Molecular Formula C52H64O4
Exact Mass 752.480461 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ghah70NLSXH
Name 5,11,17,23-Tetracyclohexyl-25,26,27,28-tetrahydroxycalix[4]arene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C52H64O4
InChI InChI=1S/C52H64O4/c53-49-41-21-37(33-13-5-1-6-14-33)22-42(49)30-44-24-39(35-17-9-3-10-18-35)26-46(51(44)55)32-48-28-40(36-19-11-4-12-20-36)27-47(52(48)56)31-45-25-38(23-43(29-41)50(45)54)34-15-7-2-8-16-34/h21-28,33-36,53-56H,1-20,29-32H2
InChIKey IOTOUYIHSSCOII-UHFFFAOYSA-N
Molecular Weight 753.080 g/mol
SMILES Oc1c2Cc3c(c(Cc4c(c(Cc5c(c(Cc1cc(c2)C1CCCCC1)cc(c5)C1CCCCC1)O)cc(c4)C1CCCCC1)O)cc(c3)C1CCCCC1)O
SPLASH splash10-0uxr-5010004900-c9aa30d131508bac9f6f
Source of Spectrum F-48-910-6
Synonyms 5,11,17,23-tetracyclohexylpentacyclo[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-25,26,27,28-tetrol
Wiley ID 1416381