| SpectraBase Spectrum ID |
r7UBeCmdOl |
| Name |
1,3-Cyclohexanediol, 4,6-dimethyl-2-nitro-, monoacetate (ester), [1S-(1.alpha.,2.beta.,3.alpha.,4.beta.,6.beta.)]- |
| CAS Registry Number |
114454-87-4 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C10H17NO5 |
| InChI |
InChI=1S/C10H17NO5/c1-5-4-6(2)10(16-7(3)12)8(9(5)13)11(14)15/h5-6,8-10,13H,4H2,1-3H3 |
| InChIKey |
JCWBWCACFWDMSZ-UHFFFAOYSA-N |
| Molecular Weight |
231.248 g/mol |
| SMILES |
OC1C(CC(C(C1N(=O)=O)OC(=O)C)C)C |
| SPLASH |
splash10-004l-5900000000-7087a84a573d55aa52f4 |
| Source of Spectrum |
H-71-13-10 |
| Synonyms |
3-Hydroxy-4,6-dimethyl-2-nitrocyclohexyl acetate
(4,6-dimethyl-2-nitro-3-oxidanyl-cyclohexyl) ethanoate
Acetic acid (3-hydroxy-4,6-dimethyl-2-nitro-cyclohexyl) ester
Acetic acid (3-hydroxy-4,6-dimethyl-2-nitrocyclohexyl) ester
(3-hydroxy-4,6-dimethyl-2-nitrocyclohexyl) acetate |
| Wiley ID |
1232544 |
![1,3-CYCLOHEXANEDIOL, 4,6-DIMETHYL-2-NITRO-, MONOACETATE (ESTER), [1S-(1alpha,2beta,3alpha,4beta,6beta)]-](/api/spectrum/r7UBeCmdOl/structure.png?h=300&w=458 "1,3-CYCLOHEXANEDIOL, 4,6-DIMETHYL-2-NITRO-, MONOACETATE (ESTER), [1S-(1alpha,2beta,3alpha,4beta,6beta)]-")
