| SpectraBase Compound ID | 3m4Ammbvj9V |
|---|---|
| InChI | InChI=1S/C12H24O2/c1-5-6-7-8-9-10-14-11(13)12(2,3)4/h5-10H2,1-4H3 |
| InChIKey | VJQPQMJCZDBCEQ-UHFFFAOYSA-N |
| Mol Weight | 200.32 g/mol |
| Molecular Formula | C12H24O2 |
| Exact Mass | 200.17763 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | FBr4BiC6Qf2 |
|---|---|
| Name | PROPANOIC ACID, 2,2-DIMETHYL-, HEPTYL ESTER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C12H24O2 |
| InChI | InChI=1S/C12H24O2/c1-5-6-7-8-9-10-14-11(13)12(2,3)4/h5-10H2,1-4H3 |
| InChIKey | VJQPQMJCZDBCEQ-UHFFFAOYSA-N |
| Molecular Weight | 200.1770 |
| SMILES | CC(C(OCCCCCCC)=O)(C)C |
| SPLASH | splash10-0a4i-9000000000-fe014d2c9b860ee4cd80 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |