| SpectraBase Compound ID | AFusEeL1VZw |
|---|---|
| InChI | InChI=1S/C9H16O2/c1-7-4-5-9(3,6-7)11-8(2)10/h7H,4-6H2,1-3H3 |
| InChIKey | QCUGUQOMVYFHOE-UHFFFAOYSA-N |
| Mol Weight | 156.22 g/mol |
| Molecular Formula | C9H16O2 |
| Exact Mass | 156.11503 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4ItraqHD2il |
|---|---|
| Name | 1,3-Dimethylcyclopentylacetate |
| CAS Registry Number | 56404-38-7 |
| Comments | FROM CHRISTL ASSIGNMENT TO CIS- OR TRANS-ISOMER UNCERTAIN |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C9H16O2 |
| InChI | InChI=1S/C9H16O2/c1-7-4-5-9(3,6-7)11-8(2)10/h7H,4-6H2,1-3H3 |
| InChIKey | QCUGUQOMVYFHOE-UHFFFAOYSA-N |
| NMR Standard | CS2 |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | Dioxane |