| SpectraBase Spectrum ID |
4sybpfORgPE |
| Name |
benzyl 2-acetamido-3-(2-bromo-2-chloro-1,1-difluoro-ethyl)sulfanyl-propanoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
428.961261544 u |
| Formula |
C14H15BrClF2NO3S |
| InChI |
InChI=1S/C14H15BrClF2NO3S/c1-9(20)19-11(8-23-14(17,18)13(15)16)12(21)22-7-10-5-3-2-4-6-10/h2-6,11,13H,7-8H2,1H3,(H,19,20) |
| InChIKey |
OPOWAHAWIVBXOI-UHFFFAOYSA-N |
| Instrument Name |
GCMS |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/jssc.200600322 |
| Molecular Weight |
430.692 g/mol |
| Quality |
804 |
| SMILES |
N(C(CSC(C(Br)Cl)(F)F)C(=O)OCC1=CC=CC=C1)C(C)=O |
| SPLASH |
splash10-052f-9370000000-4353b98bef27e054b87a |
| Source of Spectrum |
SEP-30-156-Figure 4-B (DOI: 10.1002/jssc.200600322) |
| Wiley ID |
1909605 |
