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5-isothiocyanato-1,2,3-trimethoxybenzene

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5-isothiocyanato-1,2,3-trimethoxybenzene
SpectraBase Compound ID A55jJevuAza
InChI InChI=1S/C10H11NO3S/c1-12-8-4-7(11-6-15)5-9(13-2)10(8)14-3/h4-5H,1-3H3
InChIKey AFWKAIYTSPWWCA-UHFFFAOYSA-N
Mol Weight 225.26 g/mol
Molecular Formula C10H11NO3S
Exact Mass 225.045964 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 94fcOy3vT8l
Name 3,4,5-Trimethoxyphenyl isothiocyanate
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 511854
Copyright Copyright © 2021-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H11NO3S
InChI InChI=1S/C10H11NO3S/c1-12-8-4-7(11-6-15)5-9(13-2)10(8)14-3/h4-5H,1-3H3
InChIKey AFWKAIYTSPWWCA-UHFFFAOYSA-N
Molecular Weight 225.262 g/mol
Observed nucleus 13C
Purity 98%
Solvent DMSO-d6
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_13CNMR_014976