| SpectraBase Compound ID | 7TJOQPD73mK |
|---|---|
| InChI | InChI=1S/C12H22O4/c1-4-7-10(12(14)16-3)8-5-6-9-11(13)15-2/h10H,4-9H2,1-3H3 |
| InChIKey | FTDNFRCIZCKCQR-UHFFFAOYSA-N |
| Mol Weight | 230.3 g/mol |
| Molecular Formula | C12H22O4 |
| Exact Mass | 230.151809 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | BOzRYrCSQ9f |
|---|---|
| Name | HEPTANEDIOIC ACID, 2-PROPYL-, DIMETHYL ESTER |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C12H22O4 |
| InChI | InChI=1S/C12H22O4/c1-4-7-10(12(14)16-3)8-5-6-9-11(13)15-2/h10H,4-9H2,1-3H3 |
| InChIKey | FTDNFRCIZCKCQR-UHFFFAOYSA-N |
| Instrument Name | CH7 |
| Molecular Weight | 230.1512 |
| SMILES | CCCC(CCCCC(OC)=O)C(OC)=O |
| SPLASH | splash10-0ap3-9300000000-f91f1fc41f5f40a5359f |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |