| SpectraBase Spectrum ID |
86MwnVXu0N6 |
| Name |
2,4,5-T isobutylester |
| CAS Registry Number |
4938-72-1 |
| Classification |
Herbicide |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
309.993027376 u |
| Formula |
C12H13Cl3O3 |
| InChI |
InChI=1S/C12H13Cl3O3/c1-3-7(2)18-12(16)6-17-11-5-9(14)8(13)4-10(11)15/h4-5,7H,3,6H2,1-2H3 |
| InChIKey |
KOCPUBZALOBLTB-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
311.592 g/mol |
| SMILES |
c1c(c(cc(c1Cl)Cl)Cl)OCC(OC(CC)C)=O |
| SPLASH |
splash10-0bt9-7893000000-0d894e01512d77788817 |
| 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 |
2,4,5-Trichlorophenoxyacetic acid (T) isobutylester |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_1956 |
