| SpectraBase Spectrum ID |
DURfxjg7I9Y |
| Name |
Dinitramine |
| Source of Sample |
Sigma-Aldrich Cat. #34333 |
| CAS Registry Number |
29091-05-2 |
| Classification |
Pesticides: Herbicides |
| Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
322.088889400 u |
| Formula |
C11H13F3N4O4 |
| InChI |
InChI=1S/C11H13F3N4O4/c1-3-16(4-2)9-7(17(19)20)5-6(11(12,13)14)8(15)10(9)18(21)22/h5H,3-4,15H2,1-2H3 |
| InChIKey |
OFDYMSKSGFSLLM-UHFFFAOYSA-N |
| Molecular Weight |
322.244 g/mol |
| Number of Peaks |
268 |
| RI1 |
1811 |
| SMILES |
Nc1c(cc(c(c1N(=O)=O)N(CC)CC)N(=O)=O)C(F)(F)F |
| SPLASH |
splash10-0a4l-3962000000-6f21595bb7f81ad948d8 |
| Sample Comments |
RI1: measured on SLB-5ms (Alkanes)
RI2: measured on Equity-1 (Alkanes) |
| Source of Spectrum |
Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy) |
| Synonyms |
1,3-Benzenediamine, N1,N1-diethyl-2,6-dinitro-4-(trifluoromethyl)- |
| Wiley ID |
LM_PEST_542 |
