| SpectraBase Compound ID | 4Iw1wTkqU7Q |
|---|---|
| InChI | InChI=1S/C9H18O/c1-5-6-7-8(10)9(2,3)4/h5-7H2,1-4H3 |
| InChIKey | ZLMHETMAEHQFHK-UHFFFAOYSA-N |
| Mol Weight | 142.24 g/mol |
| Molecular Formula | C9H18O |
| Exact Mass | 142.135765 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | DUBpYXWy2CQ |
|---|---|
| Name | 2,2-Dimethyl-3-heptanone |
| Alternate Name(s) | 2,2-Dimethylheptan-3-one |
| CAS Registry Number | 19078-97-8 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H18O |
| InChI | InChI=1S/C9H18O/c1-5-6-7-8(10)9(2,3)4/h5-7H2,1-4H3 |
| InChIKey | ZLMHETMAEHQFHK-UHFFFAOYSA-N |
| Molecular Weight | 142.242 g/mol |
| SMILES | C(=O)(C(C)(C)C)CCCC |
| SPLASH | splash10-0a4r-9000000000-205447069fe6c52ea28e |
| Source of Spectrum | NP-1-1942-0 |
| Wiley ID | 1098111 |