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25,27-Dipropanoyloxy-26,28-dihydroxycallix[4]arene

View entire compound with spectra: 1 MS (GC)

25,27-Dipropanoyloxy-26,28-dihydroxycallix[4]arene
SpectraBase Compound ID CiFcR8tuyFF
InChI InChI=1S/C34H32O6/c1-3-29(35)39-33-25-13-7-14-26(33)18-22-10-6-12-24(32(22)38)20-28-16-8-15-27(34(28)40-30(36)4-2)19-23-11-5-9-21(17-25)31(23)37/h5-16,37-38H,3-4,17-20H2,1-2H3
InChIKey ZSBZXGUYPPISLY-UHFFFAOYSA-N
Mol Weight 536.6 g/mol
Molecular Formula C34H32O6
Exact Mass 536.219889 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1YPZIctHbU
Name 25,27-Dipropanoyloxy-26,28-dihydroxycallix[4]arene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H32O6
InChI InChI=1S/C34H32O6/c1-3-29(35)39-33-25-13-7-14-26(33)18-22-10-6-12-24(32(22)38)20-28-16-8-15-27(34(28)40-30(36)4-2)19-23-11-5-9-21(17-25)31(23)37/h5-16,37-38H,3-4,17-20H2,1-2H3
InChIKey ZSBZXGUYPPISLY-UHFFFAOYSA-N
Molecular Weight 536.624 g/mol
SMILES Oc1c2Cc3cccc(Cc4c(c(Cc5c(c(Cc1ccc2)ccc5)OC(=O)CC)ccc4)O)c3OC(=O)CC
SPLASH splash10-03k9-0000930000-44f9897e58a18ad1a5ec
Source of Spectrum SK-24-15-2
Wiley ID 866099