Table 1 Details of the main peaks composing the resolved spectra obtained for each pure component using MCR-ALS and corresponding assignments17,19,36,37,38,39,58,59,60.

From: Tracking hidden organic carbon in rocks using chemometrics and hyperspectral imaging

Identification

MCR-ALS components

Band Assignment

References

1

2

3

4

7

8

Olivine

White serpentine in vein

Yellow serpentine

Saponite

Organic compounds

White serpentine

% variance

11.3

4.5

14.7

8.3

16.4

15.0

Peak positions (cm−1)

    

1466

 

C-H bending; N-H bending

17,58,59

   

1473

   

X-OH bending (X = Si, Mg, Fe)

36,37,38

     

1539

 

N-H bending; C = C stretching

17,58,59

   

1541

  

1543

X-OH bending (X = Si, Mg, Fe)

36,37,38

   

1576

   

X-OH bending (X = Si, Mg, Fe)

36,37,38

      

1597

X-OH bending (X = Si, Mg, Fe)

36,37,38

    

1628

  

interlayer H-O-H

19,38,39

  

1641

    

X-OH bending (X = Si, Mg, Fe)

36,37,38

  

1672

   

1670

X-OH bending (X = Si, Mg, Fe)

36,37,38

  

1711

    

X-OH bending (X = Si, Mg, Fe)

36,37,38

     

1730

 

aromatic C = O stretching

17,58,59

   

1747

   

X-OH bending (X = Si, Mg, Fe)

36,37,38

 

1776

     

Si-O secondary order overtone

60

     

2852

 

C-H stretching

17,58,59

     

2924

 

C-H stretching

17,58,59

     

2958

 

C-H stretching

17,58,59