For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1,8-DI-O-METHYL-ALOE-EMODIN
SpectraBase Compound ID 5279shBw9no
InChI InChI=1S/C17H14O5/c1-21-12-5-3-4-10-14(12)17(20)15-11(16(10)19)6-9(8-18)7-13(15)22-2/h3-7,18H,8H2,1-2H3
InChIKey OTBYRJZRBVFICG-UHFFFAOYSA-N
Mol Weight 298.29 g/mol
Molecular Formula C17H14O5
Exact Mass 298.084124 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID DW1Hkp7uMw3
Name Aloe-emodin 2ME
Classification Laxative
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 298.084123546 u
Formula C17H14O5
InChI InChI=1S/C17H14O5/c1-21-12-5-3-4-10-14(12)17(20)15-11(16(10)19)6-9(8-18)7-13(15)22-2/h3-7,18H,8H2,1-2H3
InChIKey OTBYRJZRBVFICG-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 298.294 g/mol
SMILES c1ccc2c(C(=O)c3c(cc(cc3C2=O)CO)OC)c1OC
SPLASH splash10-0002-1290000000-ef5332ef6a8833fb6247
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_3562