2-Hydroxy propoxycarbazone
1117
Reference
2-Hydroxy propoxycarbazone Structure
Systematic / IUPAC Name: Methyl 2-({[3-(2-hydroxypropoxy)-4-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]carbonyl}sulfamoyl)benzoate
ID: Reference1117
Other Names: Benzoic acid, 2-[({[4,5-dihydro-3-(2-hydroxypropoxy)-4-methyl-5-oxo-1H-1,2,4-triazol-1-yl]carbonyl}amino)sulfonyl]-, methyl ester
Formula: C15H18N4O8S
Class: Pesticides/Herbicides
Spectral Data
2-Hydroxy propoxycarbazone mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Available MS Data
| Used Instruments | Q Exactive Orbitrap |
| No. of Spectral Trees | 1 |
| No. of Spectra | 62 |
| Tandem Spectra | MS1, MS2 |
| Ionization Methods | ESI |
| Analyzers | FT |
| Last Modification | 10/14/2016 1:00:29 PM |
Identificators
| InChI | InChI=1S/C15H18N4O8S/c1-9(20)8-27-14-16-19(15(23)18(14)2)13(22)17-28(24,25)11-7-5-4-6-10(11)12(21)26-3/h4-7,9,20H,8H2,1-3H3,(H,17,22) |
| InChI Key | DUXDBOLTMWLLPK-UHFFFAOYSA-N |
| Canonical SMILES | CC(COC1=NN(C(=O)N1C)C(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC)O |
| CAS | 496925021 |
| Splash | |
| Other Names | Benzoic acid, 2-[({[4,5-dihydro-3-(2-hydroxypropoxy)-4-methyl-5-oxo-1H-1,2,4-triazol-1-yl]carbonyl}amino)sulfonyl]-, methyl ester |