| SpectraBase Spectrum ID |
9lEIU9eDz28 |
| Name |
Vanillin mandelic acid 2MEAC |
| Classification |
Biomolecule |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
268.094688229 u |
| Formula |
C13H16O6 |
| InChI |
InChI=1S/C13H16O6/c1-8(14)19-12(13(15)18-4)9-5-6-10(16-2)11(7-9)17-3/h5-7,12H,1-4H3 |
| InChIKey |
DRBCVTJODMPWLC-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
268.265 g/mol |
| SMILES |
C(c1cc(OC)c(cc1)OC)(C(=O)OC)OC(=O)C |
| SPLASH |
splash10-014i-2910000000-0bfc82c0a1296b0a7dcb |
| 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_5140 |
