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1-(3,4-Dimethoxy-phenyl)-2-thiocyanato-ethanone
SpectraBase Compound ID L28z1am2ctZ
InChI InChI=1S/C11H11NO3S/c1-14-10-4-3-8(5-11(10)15-2)9(13)6-16-7-12/h3-5H,6H2,1-2H3
InChIKey WAIJFLLFDYMRFP-UHFFFAOYSA-N
Mol Weight 237.27 g/mol
Molecular Formula C11H11NO3S
Exact Mass 237.045964 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BAit1kjBaKD
Name 1-(3,4-Dimethoxy-phenyl)-2-thiocyanato-ethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11NO3S
InChI InChI=1S/C11H11NO3S/c1-14-10-4-3-8(5-11(10)15-2)9(13)6-16-7-12/h3-5H,6H2,1-2H3
InChIKey WAIJFLLFDYMRFP-UHFFFAOYSA-N
Molecular Weight 237.273 g/mol
SMILES C(#N)SCC(c1cc(OC)c(cc1)OC)=O
SPLASH splash10-014i-8900000000-997a961add3d3c6c4573
Synonyms thiocyanic acid [2-(3,4-dimethoxyphenyl)-2-oxoethyl] ester [2-(3,4-dimethoxyphenyl)-2-oxoethyl] thiocyanate [2-(3,4-dimethoxyphenyl)-2-oxo-ethyl] thiocyanate [2-(3,4-dimethoxyphenyl)-2-oxidanylidene-ethyl] thiocyanate
Wiley ID 1463628