| SpectraBase Spectrum ID |
4UvBxQEypDz |
| Name |
Vanillin mandelic acid ME2AC |
| Classification |
Biomolecule |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
296.089602848 u |
| Formula |
C14H16O7 |
| InChI |
InChI=1S/C14H16O7/c1-8(15)20-11-6-5-10(7-12(11)18-3)13(14(17)19-4)21-9(2)16/h5-7,13H,1-4H3 |
| InChIKey |
MAJSZBYWQHVHEP-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
296.275 g/mol |
| SMILES |
C(c1cc(OC)c(cc1)OC(=O)C)(C(=O)OC)OC(=O)C |
| SPLASH |
splash10-0udi-2940000000-25d47ae3e4476c127de4 |
| 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_5141 |
