A diffuse reflectance Fourier transform infrared spectroscopy (DRIFTS)
investigation was performed on a series of poplin cotton fabrics trea
ted with a bifunctional reactive dye of unknown chemical structure and
composition, and in different states on the substrate (unfixed or fix
ed to the cotton substrate as well as chemically treated). The cotton-
cellulose bands (log 1/R) dominate the spectra of the dyed fabric samp
les, and this leads to difficulties in the discrimination and matching
of such spectra. However, it is demonstrated that qualitative discrim
ination is achieved by using principal component analysis (PCA). The d
ye state is the basis for this; also, within the % dye concentration s
eries separation of spectra is observed according to the amount of the
dye present. Exploratory quantitative analysis of such samples, attem
pted with partial least squares (PLS) regression, shows that it may be
possible to predict the % concentrations with larger calibration sets
. Further, series of fabrics were dyed with different reactive dyes an
d again treated to obtain various reactive dye states. The DRIFT spect
ra of these fabrics were submitted to PCA, with qualitative discrimina
tion being achieved on the basis of dye colour and the reactive dye st
ate. It is shown that the spectra of the unfixed dyes are similar to t
hose of the neat dye powders. This study indicates that DRIFTS may be
useful for matching, discrimination and prediction of reactive dyes on
cotton substrates even if the dye structure is unavailable. This poin
ts to potential applications in the dye and general textile industry a
s well as specific forensic cases involving relatively large samples.
In addition, it is clear that further carefully designed experiments m
ay lead to a clarification of the details of binding of polyfunctional
reactive dyes on cotton.