SpectraBase Spectrum ID |
1nsywym4YZU |
Name |
Methiothepin mesylate |
Source of Sample |
Sigma-Aldrich Company LLC |
Catalog Number |
M149 |
Lot Number |
123M4719V |
Apodization Function |
Triangular |
CAS Registry Number |
74611-28-2 |
Copyright |
Copyright © 2012-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C21H28N2O3S3 |
InChI |
InChI=1S/C20H24N2S2.CH4O3S/c1-21-9-11-22(12-10-21)18-13-15-5-3-4-6-19(15)24-20-8-7-16(23-2)14-17(18)20;1-5(2,3)4/h3-8,14,18H,9-13H2,1-2H3;1H3,(H,2,3,4) |
InChIKey |
CZMDZGZYKOGLJY-UHFFFAOYSA-N |
Instrument Name |
Bio-Rad FTS
|
SMILES |
c12C(Cc3c(Sc2ccc(c1)SC)cccc3)N1CCN(CC1)C.OS(=O)(=O)C |
Scan Speed (number) |
5 |
Source of Spectrum |
Forensic Spectral Research |
Technique |
KBr0 |