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6,6'-Hexylenedioxy-2,2'-(6-isopropyl-3-methylcyclohexylidenedioxy)biphenyl
SpectraBase Compound ID XZMkEPxdsi
InChI InChI=1S/C28H36O4/c1-19(2)21-15-14-20(3)18-28(21)31-24-12-8-10-22-26(24)27-23(11-9-13-25(27)32-28)30-17-7-5-4-6-16-29-22/h8-13,19-21H,4-7,14-18H2,1-3H3/t20-,21-/m1/s1
InChIKey ZCVOTUVQWBMOTF-NHCUHLMSSA-N
Mol Weight 436.6 g/mol
Molecular Formula C28H36O4
Exact Mass 436.26136 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FaAAzvNuNof
Name 6,6'-Hexylenedioxy-2,2'-(6-isopropyl-3-methylcyclohexylidenedioxy)biphenyl
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H36O4
InChI InChI=1S/C28H36O4/c1-19(2)21-15-14-20(3)18-28(21)31-24-12-8-10-22-26(24)27-23(11-9-13-25(27)32-28)30-17-7-5-4-6-16-29-22/h8-13,19-21H,4-7,14-18H2,1-3H3/t20-,21-/m1/s1
InChIKey ZCVOTUVQWBMOTF-NHCUHLMSSA-N
Molecular Weight 436.592 g/mol
SMILES C12(Oc3c-4c(OCCCCCCOc5c4c(O2)ccc5)ccc3)[C@](CC[C@](C1)(C)[H])(C(C)C)[H]
SPLASH splash10-0k9i-5003900000-5db5ffe164d7d189331d
Source of Spectrum F-53-16672-11
Synonyms 5-Methyl-2-(propan-2-yl)-6',8',14',21'-tetraoxaspiro[cyclohexane-1,7'-tetracyclo[11.8.2.0(5,22).0(9,23)]tricosane]-1'(22'),2',4',9',11',13'(23')-hexaene
Wiley ID 804595