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1,2-Phthalic acid, bis-BBN-ester

View entire compound with spectra: 1 MS (GC)

1,2-Phthalic acid, bis-BBN-ester
SpectraBase Compound ID CrpTqrCVvwv
InChI InChI=1S/C24H32B2O4/c27-23(29-25-17-7-3-8-18(25)10-4-9-17)21-15-1-2-16-22(21)24(28)30-26-19-11-5-12-20(26)14-6-13-19/h1-2,15-20H,3-14H2
InChIKey DVLFCJIUFBPVQF-UHFFFAOYSA-N
Mol Weight 406.1 g/mol
Molecular Formula C24H32B2O4
Exact Mass 406.24867 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DvkPWLktcYe
Name 1,2-Phthalic acid, bis-BBN-ester
CAS Registry Number 128261-07-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H32B2O4
InChI InChI=1S/C24H32B2O4/c27-23(29-25-17-7-3-8-18(25)10-4-9-17)21-15-1-2-16-22(21)24(28)30-26-19-11-5-12-20(26)14-6-13-19/h1-2,15-20H,3-14H2
InChIKey DVLFCJIUFBPVQF-UHFFFAOYSA-N
Molecular Weight 406.136 g/mol
SMILES C1CC2B(OC(c3c(cccc3)C(=O)OB3C4CCCC3CCC4)=O)C(C1)CCC2
SPLASH splash10-0kuu-8940000000-2fd06f4bdb87ae848ef3
Synonyms 9-((2-[(9-Borabicyclo[3.3.1]non-9-yloxy)carbonyl]benzoyl)oxy)-9-borabicyclo[3.3.1]nonane benzene-1,2-dicarboxylic acid bis(9-borabicyclo[3.3.1]nonan-9-yl) ester bis(9-borabicyclo[3.3.1]nonan-9-yl) benzene-1,2-dicarboxylate
Wiley ID 1495147