| SpectraBase Compound ID | 8rmdaUiMDnA |
|---|---|
| InChI | InChI=1S/C9H18O2/c1-7(5-8(10)11)6-9(2,3)4/h7H,5-6H2,1-4H3,(H,10,11) |
| InChIKey | OILUAKBAMVLXGF-UHFFFAOYSA-N |
| Mol Weight | 158.24 g/mol |
| Molecular Formula | C9H18O2 |
| Exact Mass | 158.13068 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7hyT3Zdtnc8 |
|---|---|
| Name | 3,5,5-TRIMETHYLHEXANOIC ACID |
| Source of Sample | Eastman Organic Chemicals, Rochester, New York |
| Boiling Point | 107-109C/4mm |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H18O2 |
| InChI | InChI=1S/C9H18O2/c1-7(5-8(10)11)6-9(2,3)4/h7H,5-6H2,1-4H3,(H,10,11) |
| InChIKey | OILUAKBAMVLXGF-UHFFFAOYSA-N |
| Molecular Weight | 158.24 |
| Solvent | Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20 |
| Synonyms | HEXANOIC ACID, 3,5,5-TRIMETHYL-, |