| SpectraBase Spectrum ID |
2kFvxGxDU0 |
| Name |
Dihydroxyphenylacetic acid MEHFB |
| Classification |
Biomolecule |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
378.033820526 u |
| Formula |
C13H9F7O5 |
| InChI |
InChI=1S/C13H9F7O5/c1-24-9(22)5-6-2-3-7(21)8(4-6)25-10(23)11(14,15)12(16,17)13(18,19)20/h2-4,21H,5H2,1H3 |
| InChIKey |
PWZXKBSPAZUSGT-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
378.199 g/mol |
| SMILES |
COC(Cc1cc(c(cc1)O)OC(C(F)(C(C(F)(F)F)(F)F)F)=O)=O |
| SPLASH |
splash10-014i-9406000000-08bb930626c86b69e507 |
| 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 |
| Synonyms |
3,4-Dihydroxyphenylacetic acid MEHFB |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_5965 |
