| SpectraBase Spectrum ID |
IHJck5NWllx |
| Name |
(4S,5S,6S)-3-Chloro-4,5-isopropylidenedioxy-6-hydroxycyclohex-2-en-1-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C9H11ClO4 |
| InChI |
InChI=1S/C9H11ClO4/c1-9(2)13-7-4(10)3-5(11)6(12)8(7)14-9/h3,6-8,12H,1-2H3/t6-,7-,8+/m1/s1 |
| InChIKey |
JRAKNFSDSJSHBX-PRJMDXOYSA-N |
| Molecular Weight |
218.636 g/mol |
| SMILES |
O[C@]1([C@]2([C@@](C(Cl)=CC1=O)(OC(O2)(C)C)[H])[H])[H] |
| SPLASH |
splash10-0w29-0590000000-679cb44db2aa2cc54a93 |
| Source of Spectrum |
KD-13-2457-16 |
| Synonyms |
(3aS,4S,7aS)-7-chloro-4-hydroxy-2,2-dimethyl-3a,7a-dihydro-1,3-benzodioxol-5(4H)-one |
| Wiley ID |
1635606 |
