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Octadecanoic acid, 9,10-dihydroxy-, methyl ester, cyclic 1-butaneboronate, erythro-
SpectraBase Compound ID DLa2ly21o9h
InChI InChI=1S/C23H45BO4/c1-4-6-8-9-11-14-17-21-22(28-24(27-21)20-7-5-2)18-15-12-10-13-16-19-23(25)26-3/h21-22H,4-20H2,1-3H3
InChIKey WSVRNGNDKSLRHY-UHFFFAOYSA-N
Mol Weight 396.4 g/mol
Molecular Formula C23H45BO4
Exact Mass 396.34109 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A4HelGP41GZ
Name Octadecanoic acid, 9,10-dihydroxy-, methyl ester, cyclic 1-butaneboronate, erythro-
Alternate Name(s) n-Butylboronate of methyl 9,10-dihydroxy-stearate Methyl 8-(2-butyl-5-octyl-1,3,2-dioxaborolan-4-yl)octanoate Methyl erythro-9,10-dihydroxystearate cyclic butaneboronate Methyl erythro-9,10-dihydroxystearate n-butyl boronate Octadecanoic acid,9,10-dihydroxy-,methyl ester,cyclic-butaneboronate
CAS Registry Number 33079-15-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H45BO4
InChI InChI=1S/C23H45BO4/c1-4-6-8-9-11-14-17-21-22(28-24(27-21)20-7-5-2)18-15-12-10-13-16-19-23(25)26-3/h21-22H,4-20H2,1-3H3
InChIKey WSVRNGNDKSLRHY-UHFFFAOYSA-N
Molecular Weight 396.419 g/mol
SMILES C1(OB(OC1CCCCCCCC)CCCC)CCCCCCCC(=O)OC
SPLASH splash10-0aou-9302000000-f7e2e253bd38f10a47b5
Source of Spectrum AD-0-5078-0
Wiley ID 56773