| SpectraBase Compound ID | LRmVxNKrfUV |
|---|---|
| InChI | InChI=1S/C9H16O4/c1-4-5-6-7(8(10)12-2)9(11)13-3/h7H,4-6H2,1-3H3 |
| InChIKey | UVCBPUQNMGFVAA-UHFFFAOYSA-N |
| Mol Weight | 188.22 g/mol |
| Molecular Formula | C9H16O4 |
| Exact Mass | 188.104859 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | LpCTIxMMyFv |
|---|---|
| Name | PROPANEDIOIC ACID, BUTYL-, DIMETHYL ESTER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C9H16O4 |
| InChI | InChI=1S/C9H16O4/c1-4-5-6-7(8(10)12-2)9(11)13-3/h7H,4-6H2,1-3H3 |
| InChIKey | UVCBPUQNMGFVAA-UHFFFAOYSA-N |
| Molecular Weight | 188.1044 |
| SMILES | COC(C(CCCC)C(OC)=O)=O |
| SPLASH | splash10-0kai-9800000000-97bd9f222bd7db0d71b1 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |