| SpectraBase Spectrum ID |
1apP2dubInM |
| Name |
(1S,2S,3S)-3-bromo-2-methoxy-4-oxo-1-cyclohexanecarboxylic acid methyl ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C9H13BrO4 |
| InChI |
InChI=1S/C9H13BrO4/c1-13-8-5(9(12)14-2)3-4-6(11)7(8)10/h5,7-8H,3-4H2,1-2H3/t5-,7+,8-/m0/s1 |
| InChIKey |
DIXGZGHFCRUSHX-ARDNSNSESA-N |
| Molecular Weight |
265.103 g/mol |
| SMILES |
[C@@]1([C@@]([C@](Br)(C(CC1)=O)[H])(OC)[H])(C(=O)OC)[H] |
| SPLASH |
splash10-0002-0930000000-aa44d5348b487b96da79 |
| Source of Spectrum |
J-64-2118-18 |
| Synonyms |
(1S,2S,3S)-3-bromo-4-keto-2-methoxy-cyclohexanecarboxylic acid methyl ester
Methyl (1S,2S,3S)-3-bromanyl-2-methoxy-4-oxidanylidene-cyclohexane-1-carboxylate
Methyl (1S,2S,3S)-3-bromo-2-methoxy-4-oxo-cyclohexanecarboxylate
Methyl (1S,2S,3S)-3-bromo-2-methoxy-4-oxocyclohexane-1-carboxylate |
| Wiley ID |
1529650 |
