| SpectraBase Spectrum ID |
9GBIJYMnBpt |
| Name |
Digitoxigenin -2H2O @ |
| Classification |
Cardiac glycoside |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
338.224580204 u |
| Formula |
C23H30O2 |
| InChI |
InChI=1S/C23H30O2/c1-22-11-4-3-5-16(22)6-7-17-19-9-8-18(15-13-21(24)25-14-15)23(19,2)12-10-20(17)22/h3,5,9,13,16-18,20H,4,6-8,10-12,14H2,1-2H3 |
| InChIKey |
HKDLNIGWSYCXGU-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
338.491 g/mol |
| SMILES |
C12(C(C3CCC4C(C3CC2)(CCC=C4)C)=CCC1C1=CC(=O)OC1)C |
| SPLASH |
splash10-0a6r-4921000000-25115f2f0e67d8541d24 |
| 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 |
| Synonyms |
Digitoxin -2H2O HY |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_5243 |
