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boric acid, 4-ethyl-1-isobutylheptyl ester

View entire compound with spectra: 3 NMR

boric acid, 4-ethyl-1-isobutylheptyl ester
SpectraBase Compound ID 5Gt4no341ck
InChI InChI=1S/C39H81BO3/c1-13-19-34(16-4)22-25-37(28-31(7)8)41-40(42-38(29-32(9)10)26-23-35(17-5)20-14-2)43-39(30-33(11)12)27-24-36(18-6)21-15-3/h31-39H,13-30H2,1-12H3
InChIKey CLNCSRAGQAFLTA-UHFFFAOYSA-N
Mol Weight 608.9 g/mol
Molecular Formula C39H81BO3
Exact Mass 608.627877 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7mLDSZEt1U1
Name Boric acid, 4-ethyl-1-isobutyl-heptyl triester
CAS Registry Number 116401-07-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C39H81BO3
InChI InChI=1S/C39H81BO3/c1-13-19-34(16-4)22-25-37(28-31(7)8)41-40(42-38(29-32(9)10)26-23-35(17-5)20-14-2)43-39(30-33(11)12)27-24-36(18-6)21-15-3/h31-39H,13-30H2,1-12H3
InChIKey CLNCSRAGQAFLTA-UHFFFAOYSA-N
Instrument Name Varian CFT-20
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3