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Methyl 2-isothiocyanatoacetate

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

Methyl 2-isothiocyanatoacetate
SpectraBase Compound ID 5ciGOt7IRGD
InChI InChI=1S/C4H5NO2S/c1-7-4(6)2-5-3-8/h2H2,1H3
InChIKey GOWGDPFDGIPFIK-UHFFFAOYSA-N
Mol Weight 131.15 g/mol
Molecular Formula C4H5NO2S
Exact Mass 131.0041 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 2ges0SxHP2x
Name Methyl 2-isothiocyanatoacetate
Source of Sample Alfa Aesar, Thermo Fisher Scientific
Catalog Number L11046
Lot Number 10122228
CAS Registry Number 21055-37-8
Color Properties Yellow
Copyright Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C4H5NO2S
InChI InChI=1S/C4H5NO2S/c1-7-4(6)2-5-3-8/h2H2,1H3
InChIKey GOWGDPFDGIPFIK-UHFFFAOYSA-N
Instrument Name Bruker Tensor 27 FT-IR
Purity 98%
Source of Spectrum Bio-Rad Laboratories, Inc.
Technique Neat