| SpectraBase Compound ID | PrjN27tsIO |
|---|---|
| InChI | InChI=1S/C9H20/c1-5-7-8-9(3,4)6-2/h5-8H2,1-4H3 |
| InChIKey | BVAKDOXCVSMKHE-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 | DEDGlXe4fPD |
|---|---|
| Name | Heptane, 3,3-dimethyl- |
| Alternate Name(s) | 3,3-Dimethylheptane |
| CAS Registry Number | 4032-86-4 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H20 |
| InChI | InChI=1S/C9H20/c1-5-7-8-9(3,4)6-2/h5-8H2,1-4H3 |
| InChIKey | BVAKDOXCVSMKHE-UHFFFAOYSA-N |
| Molecular Weight | 128.259 g/mol |
| SMILES | CC(CC)(C)CCCC |
| SPLASH | splash10-05fu-9000000000-4fd456e51a1fc0ba8459 |
| Source of Spectrum | NP-0-7269-0 |
| Wiley ID | 1096752 |