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

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

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

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2h6muyC7PRA
Name 1-(1-Chloranyl-2-isothiocyanato-ethyl)-4-methoxy-benzene
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. 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
Molecular Weight 227.709 g/mol
SMILES C(N=C=S)C(c1ccc(cc1)OC)Cl
SPLASH splash10-0a4l-4900000000-247d181f2c31cf3abe49
Source of Spectrum ES-2005-1188-7
Synonyms 1-(1-Chloro-2-isothiocyanato-ethyl)-4-methoxy-benzene
Wiley ID 1563351