| SpectraBase Compound ID | 1l5mzs7Ad9y |
|---|---|
| InChI | InChI=1S/C11H20O3/c1-4-6-8-10(12)9(7-5-2)11(13)14-3/h9H,4-8H2,1-3H3 |
| InChIKey | GCSIJVAGDSZLPO-UHFFFAOYSA-N |
| Mol Weight | 200.28 g/mol |
| Molecular Formula | C11H20O3 |
| Exact Mass | 200.141245 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 5MeUyXZGLOz |
|---|---|
| Name | HEPTANOIC ACID, 3-OXO-2-PROPYL-, METHYL ESTER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C11H20O3 |
| InChI | InChI=1S/C11H20O3/c1-4-6-8-10(12)9(7-5-2)11(13)14-3/h9H,4-8H2,1-3H3 |
| InChIKey | GCSIJVAGDSZLPO-UHFFFAOYSA-N |
| Molecular Weight | 200.1407 |
| SMILES | CCCCC(C(C(OC)=O)CCC)=O |
| SPLASH | splash10-0a4i-9100000000-43b3e31ed851c46cea50 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |