Systematic / IUPAC Name: (5-Benzyl-3-furyl)methyl (1R,3R)-2,2-dimethyl-3-(2-methyl-1-propen-1-yl)cyclopropanecarboxylate
ID: Reference1578
Other Names:
Isatrin;
Biobenzyfuroline;
1R-trans-Resemethrin;
(+)-trans-Resmethrin;
5-Benzyl-3-furylmethyl (+)-trans-chrysanthemate
; more
Formula: C22H26O3
Class: Pesticides/Herbicides
Bioresmethrin mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
| Used Instruments | Q Exactive Orbitrap |
| No. of Spectral Trees | 1 |
| No. of Spectra | 41 |
| Tandem Spectra | MS1, MS2 |
| Ionization Methods | ESI |
| Analyzers | FT |
| Last Modification | 2/17/2015 11:57:52 AM |
| InChI | InChI=1S/C22H26O3/c1-15(2)10-19-20(22(19,3)4)21(23)25-14-17-12-18(24-13-17)11-16-8-6-5-7-9-16/h5-10,12-13,19-20H,11,14H2,1-4H3/t19-,20+/m1/s1 |
| InChI Key | VEMKTZHHVJILDY-UXHICEINSA-N |
| Canonical SMILES | CC(=CC1C(C1(C)C)C(=O)OCC2=COC(=C2)CC3=CC=CC=C3)C |
| CAS | 28434017 |
| Splash | |
| Other Names |
Isatrin; Biobenzyfuroline; 1R-trans-Resemethrin; (+)-trans-Resmethrin; 5-Benzyl-3-furylmethyl (+)-trans-chrysanthemate; 5-Benzyl-3-furylmethyl (1R)-trans-chrysanthemate; (5-Benzylfuran-3-yl)methyl (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropanecarboxylate |
| ChEBI | CHEBI:39280 |
| PubChem | 162381 |
| ChemSpider | 142577 |
| KEGG | C16810 |
| Wikipedia | Bioresmethrin (DE); Resmethrin |
| ChEMBL | CHEMBL2106605 |