| SpectraBase Spectrum ID |
7sG2zWPBnUp |
| Name |
(3-nitrophenyl)methyl 2-bromanyl-2,2-bis(fluoranyl)ethanoate |
| Alternate Name(s) |
(3-nitrophenyl)methyl 2-bromo-2,2-difluoro-acetate
2-bromo-2,2-difluoro-acetic acid (3-nitrobenzyl) ester
2-bromo-2,2-difluoroacetic acid (3-nitrophenyl)methyl ester |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C9H6BrF2NO4 |
| InChI |
InChI=1S/C9H6BrF2NO4/c10-9(11,12)8(14)17-5-6-2-1-3-7(4-6)13(15)16/h1-4H,5H2 |
| InChIKey |
LWYYDORQOSZDNT-UHFFFAOYSA-N |
| Molecular Weight |
310.051 g/mol |
| SMILES |
C(C(F)(F)Br)(=O)OCc1cc(ccc1)N(=O)=O |
| SPLASH |
splash10-000i-0906000000-c3ffeb347e3d213ffa01 |
| Source of Spectrum |
KC-0-728-3 |
| Wiley ID |
780804 |
