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2-Chloro-2-(4-methoxyphenyl)-ethyl-isothiocyanate

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2-Chloro-2-(4-methoxyphenyl)-ethyl-isothiocyanate
SpectraBase Compound ID g5HEjroXJl
InChI InChI=1S/C10H10ClNOS/c1-13-9-4-2-8(3-5-9)10(11)6-12-7-14/h2-5,10H,6H2,1H3
InChIKey PZLKGOTXRVOKRY-UHFFFAOYSA-N
Mol Weight 227.71 g/mol
Molecular Formula C10H10ClNOS
Exact Mass 227.017163 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CrWh056vOsi
Name 2-CHLORO-2-(4-METHOXYPHENYL)-ETHYL-ISOTHIOCYANATE
Compound Number 7
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H10ClNOS
InChI InChI=1S/C10H10ClNOS/c1-13-9-4-2-8(3-5-9)10(11)6-12-7-14/h2-5,10H,6H2,1H3
InChIKey PZLKGOTXRVOKRY-UHFFFAOYSA-N
Literature Reference Author S.H.V.REUSS,W.A.KOENIG
Literature Reference Citation EUR.J.ORG.CHEM.,1184(2005)
Molecular Weight 227.708 g/mol
Sample ID 30870
Solvent C6D6