| SpectraBase Spectrum ID |
B5tTlvYvaMG |
| Name |
Chrysophanol |
| CAS Registry Number |
481-74-3 |
| Classification |
Laxative |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
254.057908798 u |
| Formula |
C15H10O4 |
| InChI |
InChI=1S/C15H10O4/c1-7-5-9-13(11(17)6-7)15(19)12-8(14(9)18)3-2-4-10(12)16/h2-6,16-17H,1H3 |
| InChIKey |
LQGUBLBATBMXHT-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
254.241 g/mol |
| SMILES |
c1c(c2c(cc1)C(c1c(c(cc(c1)C)O)C2=O)=O)O |
| SPLASH |
splash10-0udi-6890000000-742b7cd602467008b34d |
| 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_3554 |
