| SpectraBase Compound ID | JpezHPaYfOF |
|---|---|
| InChI | InChI=1S/C7H14O/c1-7(8)5-3-2-4-6-7/h8H,2-6H2,1H3 |
| InChIKey | VTBOTOBFGSVRMA-UHFFFAOYSA-N |
| Mol Weight | 114.19 g/mol |
| Molecular Formula | C7H14O |
| Exact Mass | 114.104465 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Gjcpwo2s9r6 |
|---|---|
| Name | |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C7H11OD3 |
| InChI | InChI=1S/C7H14O/c1-7(8)5-3-2-4-6-7/h8H,2-6H2,1H3 |
| InChIKey | VTBOTOBFGSVRMA-UHFFFAOYSA-N |
| Molecular Weight | 114.1041 |
| SMILES | OC1(C)CCCCC1 |
| SPLASH | splash10-00di-9000000000-89a4729485641b3c6aea |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |