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2-(3,4-Dimethoxyphenyl)ethyl isothiocyanate

View entire compound with spectra: 2 FTIR, and 1 Raman

2-(3,4-Dimethoxyphenyl)ethyl isothiocyanate
SpectraBase Compound ID 7a3o2aa2pvw
InChI InChI=1S/C11H13NO2S/c1-13-10-4-3-9(5-6-12-8-15)7-11(10)14-2/h3-4,7H,5-6H2,1-2H3
InChIKey GHYFLDWHIVKQLS-UHFFFAOYSA-N
Mol Weight 223.29 g/mol
Molecular Formula C11H13NO2S
Exact Mass 223.0667 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID DIpWbKgb1wW
Name 2-(3,4-Dimethoxyphenyl)ethyl isothiocyanate
Source of Sample Alfa Aesar, Thermo Fisher Scientific
Catalog Number L11817
Lot Number J11W031
CAS Registry Number 21714-25-0
Color Properties Yellow
Copyright Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H13NO2S
InChI InChI=1S/C11H13NO2S/c1-13-10-4-3-9(5-6-12-8-15)7-11(10)14-2/h3-4,7H,5-6H2,1-2H3
InChIKey GHYFLDWHIVKQLS-UHFFFAOYSA-N
Instrument Name Bruker Tensor 27 FT-IR
Molecular Weight 223.290 g/mol
Purity 98%
Source of Spectrum Bio-Rad Laboratories, Inc.
Technique ATR-Neat (DuraSamplIR II)