| SpectraBase Spectrum ID |
Bc6qqNgxDEQ |
| Name |
Rhein 3ME |
| Classification |
Laxative |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
326.079038165 u |
| Formula |
C18H14O6 |
| InChI |
InChI=1S/C18H14O6/c1-22-12-6-4-5-10-14(12)17(20)15-11(16(10)19)7-9(18(21)24-3)8-13(15)23-2/h4-8H,1-3H3 |
| InChIKey |
BTJNSKRJTWQUNP-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
326.304 g/mol |
| SMILES |
c1ccc2C(c3c(c(cc(c3)C(=O)OC)OC)C(c2c1OC)=O)=O |
| SPLASH |
splash10-03di-3769000000-ac37408cf12daea7131c |
| 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_3572 |
