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isocyanic acid, o-ethoxyphenyl ester

View entire compound with spectra: 4 NMR, 4 FTIR, and 1 Raman

isocyanic acid, o-ethoxyphenyl ester
SpectraBase Compound ID BFCsdKvKDW
InChI InChI=1S/C9H9NO2/c1-2-12-9-6-4-3-5-8(9)10-7-11/h3-6H,2H2,1H3
InChIKey BUIQXUQLYZPMLS-UHFFFAOYSA-N
Mol Weight 163.18 g/mol
Molecular Formula C9H9NO2
Exact Mass 163.063329 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HyninQSHVKb
Name 2-Ethoxyphenyl isocyanate
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 252344
CAS Registry Number 5395-71-1
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9NO2
InChI InChI=1S/C9H9NO2/c1-2-12-9-6-4-3-5-8(9)10-7-11/h3-6H,2H2,1H3
InChIKey BUIQXUQLYZPMLS-UHFFFAOYSA-N
Observed nucleus 13C
Purity 98%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_13CNMR_004371