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(2,5-Dibutyltetrahydro-3bh-[1,3,2]dioxaborolo[4',5':4,5]furo[3,2-d][1,3,2]dioxaborinin-7-yl)methyl dimethyl phosphate
SpectraBase Compound ID 2QL2VjgpZLx
InChI InChI=1S/C16H31B2O9P/c1-5-7-9-17-24-12(11-22-28(19,20-3)21-4)13-14(25-17)15-16(23-13)27-18(26-15)10-8-6-2/h12-16H,5-11H2,1-4H3
InChIKey QZAAFBKTRGZQCM-UHFFFAOYSA-N
Mol Weight 420.0 g/mol
Molecular Formula C16H31B2O9P
Exact Mass 420.18918 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IOD6cz0woUE
Name (2,5-Dibutyltetrahydro-3bh-[1,3,2]dioxaborolo[4',5':4,5]furo[3,2-d][1,3,2]dioxaborinin-7-yl)methyl dimethyl phosphate
CAS Registry Number 58641-96-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H31B2O9P
InChI InChI=1S/C16H31B2O9P/c1-5-7-9-17-24-12(11-22-28(19,20-3)21-4)13-14(25-17)15-16(23-13)27-18(26-15)10-8-6-2/h12-16H,5-11H2,1-4H3
InChIKey QZAAFBKTRGZQCM-UHFFFAOYSA-N
Molecular Weight 420.009 g/mol
SMILES C12C3C(OB(O3)CCCC)OC1C(COP(=O)(OC)OC)OB(O2)CCCC
SPLASH splash10-004r-5941000000-81e443c616ab9bc73614
Source of Spectrum O-10-1014-2
Synonyms .alpha.-D-Glucofuranose, cyclic 1,2:3,5-bis(butylboronate) 6-(dimethyl phosphate) 7H-1,3,2-Dioxaborolo[4,5]furo[3,2-d][1,3,2]dioxaborin, .alpha.-D-glucofuranose deriv. (2,7-dibutyl-4a,5,8a,8b-tetrahydro-3aH-[1,3,2]dioxaborolo[3,4]furo[1,3-b][1,3,2]dioxaborinin-5-yl)methyl dimethyl phosphate
Wiley ID 1377760