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2-(4-Hexyloxy-5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphthalen-2-yl)-1,3,6,2-dioxazaborocane
SpectraBase Compound ID 1BbCRRD3tsZ
InChI InChI=1S/C24H40BNO3/c1-6-7-8-9-14-27-21-18-19(25-28-15-12-26-13-16-29-25)17-20-22(21)24(4,5)11-10-23(20,2)3/h17-18,26H,6-16H2,1-5H3
InChIKey HMLUWIQEYDGOQI-UHFFFAOYSA-N
Mol Weight 401.4 g/mol
Molecular Formula C24H40BNO3
Exact Mass 401.310124 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cbnlgn0D8y
Name 2-(4-Hexyloxy-5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphthalen-2-yl)-1,3,6,2-dioxazaborocane
Appearance White powder
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Formula C24H40BNO3
InChI InChI=1S/C24H40BNO3/c1-6-7-8-9-14-27-21-18-19(25-28-15-12-26-13-16-29-25)17-20-22(21)24(4,5)11-10-23(20,2)3/h17-18,26H,6-16H2,1-5H3
InChIKey HMLUWIQEYDGOQI-UHFFFAOYSA-N
Instrument Name Hewlett-Packard HP59970
Ionization Type EI
Literature Reference DOI 10.1021/jm900096q
Molecular Weight 401.398 g/mol
Reported Formula C24H40BNO3
SMILES N1CCOB(OCC1)c1cc(OCCCCCC)c2c(c1)C(CCC2(C)C)(C)C
SPLASH splash10-0fe0-0449400000-36558f5006428b5185ce
Source of Spectrum AF-52-SM9-22f
Wiley ID 1873535