| SpectraBase Spectrum ID |
7T9Zs8INmAY |
| Name |
Danthron |
| CAS Registry Number |
117-10-2 |
| Classification |
Laxative |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
240.042258734 u |
| Formula |
C14H8O4 |
| InChI |
InChI=1S/C14H8O4/c15-9-5-1-3-7-11(9)14(18)12-8(13(7)17)4-2-6-10(12)16/h1-6,15-16H |
| InChIKey |
QBPFLULOKWLNNW-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
240.214 g/mol |
| SMILES |
c1c(c2c(cc1)C(c1c(C2=O)c(ccc1)O)=O)O |
| SPLASH |
splash10-0006-7590000000-171ccf8a648e14772795 |
| 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_3555 |
