| SpectraBase Compound ID | GgVHCOq5yvD |
|---|---|
| InChI | InChI=1S/C12H22O/c1-10-6-4-8-12(2,3)11(10)7-5-9-13/h13H,4-9H2,1-3H3 |
| InChIKey | OWIZBHRKPGPVJL-UHFFFAOYSA-N |
| Mol Weight | 182.31 g/mol |
| Molecular Formula | C12H22O |
| Exact Mass | 182.167065 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | G4ibMLpKaJA |
|---|---|
| Name | |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C12H21OD |
| InChI | InChI=1S/C12H22O/c1-10-6-4-8-12(2,3)11(10)7-5-9-13/h13H,4-9H2,1-3H3 |
| InChIKey | OWIZBHRKPGPVJL-UHFFFAOYSA-N |
| Molecular Weight | 182.1665 |
| SMILES | OCCCC1=C(C)CCCC1(C)C |
| SPLASH | splash10-00ec-9500000000-8ecf9d3ce530efc97dd9 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |