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2,3-bis(Hexyloxy)-5,5a,6,11,11a,12-hexahydro-5,12 : 6,11-diepoxynaphthacene
SpectraBase Compound ID H4TvI6Vw4D9
InChI InChI=1S/C30H38O4/c1-3-5-7-11-15-31-23-17-21-22(18-24(23)32-16-12-8-6-4-2)30-26-25(29(21)34-30)27-19-13-9-10-14-20(19)28(26)33-27/h9-10,13-14,17-18,25-30H,3-8,11-12,15-16H2,1-2H3
InChIKey BDPRAROPARMZJF-UHFFFAOYSA-N
Mol Weight 462.6 g/mol
Molecular Formula C30H38O4
Exact Mass 462.27701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BKsHwWtPNGI
Name 2,3-bis(Hexyloxy)-5,5a,6,11,11a,12-hexahydro-5,12 : 6,11-diepoxynaphthacene
Alternate Name(s) 6,7-bis(hexyloxy)-19,20-dioxahexacyclo[10.6.1.1(3,10).0(2,11).0(4,9).0(13,18)]icosa-4,6,8,13,15,17-hexaene
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Formula C30H38O4
InChI InChI=1S/C30H38O4/c1-3-5-7-11-15-31-23-17-21-22(18-24(23)32-16-12-8-6-4-2)30-26-25(29(21)34-30)27-19-13-9-10-14-20(19)28(26)33-27/h9-10,13-14,17-18,25-30H,3-8,11-12,15-16H2,1-2H3
InChIKey BDPRAROPARMZJF-UHFFFAOYSA-N
Molecular Weight 462.630 g/mol
SMILES C12C(C3OC2c2c3cc(c(c2)OCCCCCC)OCCCCCC)C2OC1c1c2cccc1
SPLASH splash10-00kg-6419200000-a6d8a5e87a4c48b6b6b1
Source of Spectrum U-1997-667-5
Wiley ID 769593