| SpectraBase Spectrum ID |
gjnGF7S0O |
| Name |
Pyritinol 3ME |
| Classification |
Stimulant |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
410.133399669 u |
| Formula |
C19H26N2O4S2 |
| InChI |
InChI=1S/C19H26N2O4S2/c1-12-18(24-4)16(8-22)14(6-20-12)10-26-27-11-15-7-21-13(2)19(25-5)17(15)9-23-3/h6-7,22H,8-11H2,1-5H3 |
| InChIKey |
YBCAWMBKWUCYPB-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
410.547 g/mol |
| SMILES |
c1(cnc(c(OC)c1CO)C)CSSCc1cnc(c(OC)c1COC)C |
| SPLASH |
splash10-014r-1900000000-e017c30341b11d9c81b5 |
| Sample Comments |
The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database. |
| Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_951 |
