| SpectraBase Spectrum ID |
5nLSJQSrHl0 |
| Name |
Bromopropylate |
| Source of Sample |
Sigma-Aldrich Cat. #45357 |
| CAS Registry Number |
18181-80-1 |
| Classification |
Pesticides: Insecticides |
| 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 |
425.946620372 u |
| Formula |
C17H16Br2O3 |
| InChI |
InChI=1S/C17H16Br2O3/c1-11(2)22-16(20)17(21,12-3-7-14(18)8-4-12)13-5-9-15(19)10-6-13/h3-11,21H,1-2H3 |
| InChIKey |
FOANIXZHAMJWOI-UHFFFAOYSA-N |
| Molecular Weight |
428.120 g/mol |
| Number of Peaks |
262 |
| RI1 |
2460 |
| SMILES |
OC(c1ccc(cc1)Br)(C(=O)OC(C)C)c1ccc(cc1)Br |
| SPLASH |
splash10-000f-2809000000-d763d2517748311631ec |
| 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 |
Benzeneacetic acid, 4-bromo-alpha-(4-bromophenyl)-alpha-hydroxy-, 1-methylethyl ester |
| Wiley ID |
LM_PEST_64 |
