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2,7-Dioxa-1,8(1,3),3,6(1,4)-tetrabenzenacyclodecaphane-1(2),6(4)-diol
SpectraBase Compound ID Lr26DzPq415
InChI InChI=1S/C28H24O4/c29-25-14-10-22-7-6-20-2-1-3-24(16-20)32-27-15-11-21(17-26(27)30)5-4-19-8-12-23(13-9-19)31-28(25)18-22/h1-3,8-18,29-30H,4-7H2
InChIKey HERFGBJXHYXNRT-UHFFFAOYSA-N
Mol Weight 424.5 g/mol
Molecular Formula C28H24O4
Exact Mass 424.167459 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID bE7wRazRgM
Name 2,7-Dioxa-1,8(1,3),3,6(1,4)-tetrabenzenacyclodecaphane-1(2),6(4)-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H24O4
InChI InChI=1S/C28H24O4/c29-25-14-10-22-7-6-20-2-1-3-24(16-20)32-27-15-11-21(17-26(27)30)5-4-19-8-12-23(13-9-19)31-28(25)18-22/h1-3,8-18,29-30H,4-7H2
InChIKey HERFGBJXHYXNRT-UHFFFAOYSA-N
Literature Reference DOI 10.1002/rcm.2972
Molecular Weight 424.496 g/mol
SMILES Oc1cc2ccc1Oc1cc(CCc3cc(c(cc3)O)Oc3ccc(CC2)cc3)ccc1
SPLASH splash10-0229-0240900000-72798e8899037943eb41
Source of Spectrum RCM-21-1370-12
Synonyms 2,15-Dioxapentacyclo[20.2.2.216,19.13,7.110,14]triaconta-1(24),3,5,7(30),10,12,14(29),16,18,22,25,27-dodecaene-4,17-diol
Wiley ID 1820614