| SpectraBase Spectrum ID |
LtqIK9Ty0m |
| Name |
Rhein 2ME |
| Classification |
Laxative |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
312.063388100 u |
| Formula |
C17H12O6 |
| InChI |
InChI=1S/C17H12O6/c1-22-12-7-8(17(21)23-2)6-10-14(12)16(20)13-9(15(10)19)4-3-5-11(13)18/h3-7,18H,1-2H3 |
| InChIKey |
NKRPKLSMTMVOSW-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
312.277 g/mol |
| SMILES |
c1ccc2C(c3cc(cc(c3C(c2c1O)=O)OC)C(=O)OC)=O |
| SPLASH |
splash10-03di-3693000000-fb54eaa8c5db70b98474 |
| 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_3571 |
