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Triethyl 4-phosphonocrotonate, mixture of isomers

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Triethyl 4-phosphonocrotonate, mixture of isomers
SpectraBase Compound ID 2j51V0OHbVa
InChI InChI=1S/C10H19O5P/c1-4-13-10(11)8-7-9-16(12,14-5-2)15-6-3/h7-8H,4-6,9H2,1-3H3/b8-7+
InChIKey LXLODBXSCRTXFG-BQYQJAHWSA-N
Mol Weight 250.23 g/mol
Molecular Formula C10H19O5P
Exact Mass 250.097011 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BqvyF7WRLFQ
Name Triethyl 4-phosphonocrotonate, mixture of isomers
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 116092
CAS Registry Number 10236-14-3
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H19O5P
InChI InChI=1S/C10H19O5P/c1-4-13-10(11)8-7-9-16(12,14-5-2)15-6-3/h7-8H,4-6,9H2,1-3H3/b8-7+
InChIKey LXLODBXSCRTXFG-BQYQJAHWSA-N
Observed nucleus 13C
Purity 90%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms 4-(Diethoxyphosphinyl)-2-butenoic acid ethyl ester 4-Phosphonocrotonic acid triethyl ester
Wiley ID SIAL_13CNMR_000474