| SpectraBase Spectrum ID |
KeCnwWK62M5 |
| Name |
(4S,5R,6S)-6-Bromo-3-chloro-4,5-isopropylidenedioxy-6-hydroxycyclohex-2-en-1-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C9H10BrClO3 |
| InChI |
InChI=1S/C9H10BrClO3/c1-9(2)13-7-4(11)3-5(12)6(10)8(7)14-9/h3,6-8H,1-2H3/t6-,7-,8+/m1/s1 |
| InChIKey |
QSXOXBUFNUUGNA-PRJMDXOYSA-N |
| Molecular Weight |
281.533 g/mol |
| SMILES |
[C@@]12([C@@](C(Cl)=CC([C@]2(Br)[H])=O)(OC(O1)(C)C)[H])[H] |
| SPLASH |
splash10-014i-0090000000-2711673a546b01615d33 |
| Source of Spectrum |
KD-13-2457-18 |
| Synonyms |
(3aR,4S,7aS)-4-bromo-7-chloro-2,2-dimethyl-3a,7a-dihydro-1,3-benzodioxol-5(4H)-one
(4S,5S,6S)-6-Bromo-3-chloro-4,5-isopropylidenedioxy-6-hydroxycyclohex-2-en-1-one |
| Wiley ID |
1635605 |
