| SpectraBase Compound ID | 9MYau8OHBRw |
|---|---|
| InChI | InChI=1S/C9H20/c1-6-8(3)9(4,5)7-2/h8H,6-7H2,1-5H3 |
| InChIKey | ARWOOWBJJKVYOV-UHFFFAOYSA-N |
| Mol Weight | 128.26 g/mol |
| Molecular Formula | C9H20 |
| Exact Mass | 128.156501 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3Rha1jffrw3 |
|---|---|
| Name | Hexane, 3,3,4-trimethyl- |
| Alternate Name(s) | 3,3,4-Trimethylhexane EINECS 240-810-3 |
| CAS Registry Number | 16747-31-2 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H20 |
| InChI | InChI=1S/C9H20/c1-6-8(3)9(4,5)7-2/h8H,6-7H2,1-5H3 |
| InChIKey | ARWOOWBJJKVYOV-UHFFFAOYSA-N |
| Molecular Weight | 128.259 g/mol |
| SMILES | CCC(C(CC)C)(C)C |
| SPLASH | splash10-05fu-9000000000-1d9e77333c8ef13076dd |
| Source of Spectrum | JX-2015-6-1743 |
| Wiley ID | 1728121 |