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18-Crown-6, 1-[2-(4,6-di-t-butylbenzo-1,3,2-dioxaborol-2-yl)phenyl]-
SpectraBase Compound ID Js7iCHv4Aba
InChI InChI=1S/C32H47BO8/c1-31(2,3)24-21-26(32(4,5)6)30-28(22-24)40-33(41-30)27-10-8-7-9-25(27)29-23-38-18-17-36-14-13-34-11-12-35-15-16-37-19-20-39-29/h7-10,21-22,29H,11-20,23H2,1-6H3
InChIKey NUKMHWVZKJYTTD-UHFFFAOYSA-N
Mol Weight 570.5 g/mol
Molecular Formula C32H47BO8
Exact Mass 570.336399 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Eean0b4rtrp
Name 18-Crown-6, 1-[2-(4,6-di-t-butylbenzo-1,3,2-dioxaborol-2-yl)phenyl]-
Alternate Name(s) 4,6-Ditert-butyl-2-[2-(1,4,7,10,13,16-hexaoxacyclooctadec-2-yl)phenyl]-1,3,2-benzodioxaborole 4,6-Ditert-butyl-2-[2-(1,4,7,10,13,16-hexaoxacyclooctadecan-2-yl)phenyl]-1,3,2-benzodioxaborole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H47BO8
InChI InChI=1S/C32H47BO8/c1-31(2,3)24-21-26(32(4,5)6)30-28(22-24)40-33(41-30)27-10-8-7-9-25(27)29-23-38-18-17-36-14-13-34-11-12-35-15-16-37-19-20-39-29/h7-10,21-22,29H,11-20,23H2,1-6H3
InChIKey NUKMHWVZKJYTTD-UHFFFAOYSA-N
Molecular Weight 570.530 g/mol
SMILES CC(c1cc(c2c(OB(c3c(C4COCCOCCOCCOCCOCCO4)cccc3)O2)c1)C(C)(C)C)(C)C
SPLASH splash10-0012-9312000000-eb36eca9ce2d6c6c9952
Wiley ID 1493023