Sulforaphane

2D Structure
MF: C6H11NOS2
MW: 177.3 g/mol
IUPAC Name: 1-isothiocyanato-4-methylsulfinylbutane
Calculated IR and Raman Spectra of Sulforaphane Calculated IR and Raman Spectra of Sulforaphane Calculated IR and Raman Spectra of Sulforaphane Calculated IR and Raman Spectra of Sulforaphane Calculated IR and Raman Spectra of Sulforaphane Calculated IR and Raman Spectra of Sulforaphane

Calculation


Reference

[1] Alex A. Granovsky, Firefly version 8, www http://classic.chem.msu.su/gran/firefly/index.html
[2] M.W.Schmidt, K.K.Baldridge, J.A.Boatz, S.T.Elbert, M.S.Gordon, J.H.Jensen, S.Koseki, N.Matsunaga, K.A.Nguyen, S.Su, T.L.Windus, M.Dupuis, J.A.Montgomery J.Comput.Chem. 14, 1347-1363 (1993)
[3] H.Yoshida, K.Takeda, J.Okayama, A.Ehara and H.Matsuura, J. Phys. Chem. A 106, 3580 (2002)
[4] National Center for Biotechnology Information. PubChem Compound Summary for CID 5350, Sulforaphane. https://pubchem.ncbi.nlm.nih.gov/compound/Sulforaphane. Accessed Apr. 18, 2022.