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Trimethylene borate

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 Raman

Trimethylene borate
SpectraBase Compound ID LEG4pPM64f
InChI InChI=1S/C9H18B2O6/c1-4-12-10(13-5-1)16-8-3-9-17-11-14-6-2-7-15-11/h1-9H2
InChIKey FZNHHPNJQSIEPT-UHFFFAOYSA-N
Mol Weight 243.9 g/mol
Molecular Formula C9H18B2O6
Exact Mass 244.128949 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BagB3pzd2wb
Name Trimethylene borate
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 193194
CAS Registry Number 20905-35-5
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H18B2O6
InChI InChI=1S/C9H18B2O6/c1-4-12-10(13-5-1)16-8-3-9-17-11-14-6-2-7-15-11/h1-9H2
InChIKey FZNHHPNJQSIEPT-UHFFFAOYSA-N
Observed nucleus 13C
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms 1,3-Propanediol cyclic ester with boric acid
Wiley ID SIAL_13CNMR_002638