| SpectraBase Spectrum ID |
HoyCgZZE9CO |
| Name |
(-)-Bromoxone |
| Alternate Name(s) |
(1S,5R,6S)-3-bromo-5-hydroxy-7-oxabicyclo[4.1.0]hept-3-en-2-one
(1S,2R,6S)-4-bromanyl-2-oxidanyl-7-oxabicyclo[4.1.0]hept-3-en-5-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C6H5BrO3 |
| InChI |
InChI=1S/C6H5BrO3/c7-2-1-3(8)5-6(10-5)4(2)9/h1,3,5-6,8H/t3-,5+,6-/m1/s1 |
| InChIKey |
LCDPFZRKMYSWHQ-PQLUHFTBSA-N |
| Literature Reference DOI |
10.1021/ol9016657 |
| Molecular Weight |
205.007 g/mol |
| SMILES |
O[C@@]1(C=C(Br)C(=O)[C@@]2([C@]1(O2)[H])[H])[H] |
| SPLASH |
splash10-004j-7910000000-42e619b7589b457316f4 |
| Source of Spectrum |
A1-11-4290/SMS9-ent_1 |
| Wiley ID |
1757412 |
