| SpectraBase Spectrum ID |
JxoXu4fkK5U |
| Name |
(1R,2S,3R,4S)-3-(4'-Chlorophenyl)-1-methyl-2,4-dinitrocyclohexan-1-ol |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H15ClN2O5 |
| InChI |
InChI=1S/C13H15ClN2O5/c1-13(17)7-6-10(15(18)19)11(12(13)16(20)21)8-2-4-9(14)5-3-8/h2-5,10-12,17H,6-7H2,1H3/t10-,11+,12-,13+/m0/s1 |
| InChIKey |
FXEHLVNKKMPSPF-QNWHQSFQSA-N |
| Literature Reference DOI |
10.1002/adsc.201300039 |
| Molecular Weight |
314.725 g/mol |
| SMILES |
O[C@]1([C@]([C@@]([C@](CC1)([N+](=O)[O-])[H])(c1ccc(cc1)Cl)[H])([N+](=O)[O-])[H])C |
| SPLASH |
splash10-00bc-1931000000-e628606db67f1a3961b7 |
| Source of Spectrum |
ASC-355-1133-11b |
| Synonyms |
(1R,2S,3R,4S)-3-(4-chlorophenyl)-1-methyl-2,4-dinitrocyclohexanol |
| Wiley ID |
1762013 |
