| SpectraBase Spectrum ID |
53sleJRVk96 |
| Name |
4-Methylcatechol HFB |
| Classification |
Biomolecule |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
320.028341223 u |
| Formula |
C11H7F7O3 |
| InChI |
InChI=1S/C11H7F7O3/c1-5-2-3-7(6(19)4-5)21-8(20)9(12,13)10(14,15)11(16,17)18/h2-4,19H,1H3 |
| InChIKey |
NMDPQHUEDSLBSH-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
320.163 g/mol |
| SMILES |
c1cc(c(cc1C)O)OC(C(C(C(F)(F)F)(F)F)(F)F)=O |
| SPLASH |
splash10-00xr-9501000000-071183f4d65e37083418 |
| 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_5990 |
