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2-Adamantyldibenzo-18-crown-6
SpectraBase Compound ID DOGLenTezl5
InChI InChI=1S/C30H38O6/c1-2-4-27-26(3-1)33-11-7-31-9-13-35-28-6-5-23(20-29(28)36-14-10-32-8-12-34-27)30-24-16-21-15-22(18-24)19-25(30)17-21/h1-6,20-22,24-25,30H,7-19H2/t21-,22+,24-,25+,30?
InChIKey RXVNHLHYBXQGRM-OBKKBBDJSA-N
Mol Weight 494.6 g/mol
Molecular Formula C30H38O6
Exact Mass 494.266839 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1ORuIhEwELf
Name 2-Adamantyldibenzo-18-crown-6
Alternate Name(s) 2-(2-adamantyl)-6,7,9,10,17,18,20,21-octahydrodibenzo[b,k][1,4,7,10,13,16]hexaoxacyclooctadecin
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Formula C30H38O6
InChI InChI=1S/C30H38O6/c1-2-4-27-26(3-1)33-11-7-31-9-13-35-28-6-5-23(20-29(28)36-14-10-32-8-12-34-27)30-24-16-21-15-22(18-24)19-25(30)17-21/h1-6,20-22,24-25,30H,7-19H2/t21-,22+,24-,25+,30?
InChIKey RXVNHLHYBXQGRM-OBKKBBDJSA-N
Molecular Weight 494.628 g/mol
SMILES c1(C2[C@]3(C[C@]4(C[C@@]2(C[C@@](C3)(C4)[H])[H])[H])[H])cc2OCCOCCOc3ccccc3OCCOCCOc2cc1
SPLASH splash10-0006-0340900000-2af444246d7ee32944a9
Source of Spectrum O1-32-810-7
Wiley ID 818975