| SpectraBase Spectrum ID |
HDLRfyB2i7y |
| Name |
Cyclohexanecarboxylic acid, 3,3-dibromo-1-methyl-2-oxo-, methyl ester |
| Alternate Name(s) |
Methyl 3,3-dibromo-1-methyl-2-oxocyclohexanecarboxylate |
| CAS Registry Number |
124182-96-3 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C9H12Br2O3 |
| InChI |
InChI=1S/C9H12Br2O3/c1-8(7(13)14-2)4-3-5-9(10,11)6(8)12/h3-5H2,1-2H3 |
| InChIKey |
ORXSSTHMPFRUAD-UHFFFAOYSA-N |
| Molecular Weight |
328.000 g/mol |
| SMILES |
C1(C(C(Br)(Br)CCC1)=O)(C(=O)OC)C |
| SPLASH |
splash10-004i-0009000000-fc4fc5daeae4cdf9092c |
| Source of Spectrum |
I-67-43-20 |
| Wiley ID |
1324313 |
