| SpectraBase Spectrum ID |
CpT2nNX7NiW |
| Name |
Danthron AC |
| Classification |
Laxative |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
282.052823417 u |
| Formula |
C16H10O5 |
| InChI |
InChI=1S/C16H10O5/c1-8(17)21-12-7-3-5-10-14(12)16(20)13-9(15(10)19)4-2-6-11(13)18/h2-7,18H,1H3 |
| InChIKey |
BSSOWGKQINNSBC-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
282.251 g/mol |
| SMILES |
c1ccc2c(C(=O)c3c(cccc3OC(C)=O)C2=O)c1O |
| SPLASH |
splash10-0006-3490000000-00502cf439077bd056b5 |
| 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_3678 |
