| SpectraBase Compound ID | KDvAlCGQarb |
|---|---|
| InChI | InChI=1S/C7H16/c1-4-5-6-7(2)3/h7H,4-6H2,1-3H3 |
| InChIKey | GXDHCNNESPLIKD-UHFFFAOYSA-N |
| Mol Weight | 100.2 g/mol |
| Molecular Formula | C7H16 |
| Exact Mass | 100.125201 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 98dC3NVnqQ4 |
|---|---|
| Name | Hexane, 2-methyl- |
| Alternate Name(s) | 2-Methylhexane Isoheptane D 726 EINECS 209-730-6 NSC 24840 |
| CAS Registry Number | 591-76-4 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H16 |
| InChI | InChI=1S/C7H16/c1-4-5-6-7(2)3/h7H,4-6H2,1-3H3 |
| InChIKey | GXDHCNNESPLIKD-UHFFFAOYSA-N |
| Molecular Weight | 100.205 g/mol |
| SMILES | CC(CCCC)C |
| SPLASH | splash10-0006-9000000000-2e720fe46e9b803d0e94 |
| Source of Spectrum | HE-1982-0-0 |
| Wiley ID | 1119929 |