| SpectraBase Compound ID | 7CRRTCMj2X |
|---|---|
| InChI | InChI=1S/C13H26OS/c1-3-5-7-8-9-10-11-13(14)15-12-6-4-2/h3-12H2,1-2H3 |
| InChIKey | SOUKVOMQRODAPB-UHFFFAOYSA-N |
| Mol Weight | 230.41 g/mol |
| Molecular Formula | C13H26OS |
| Exact Mass | 230.170437 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 24gL9ppOqVf |
|---|---|
| Name | nonanethioic acid S-butyl ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H26OS |
| InChI | InChI=1S/C13H26OS/c1-3-5-7-8-9-10-11-13(14)15-12-6-4-2/h3-12H2,1-2H3 |
| InChIKey | SOUKVOMQRODAPB-UHFFFAOYSA-N |
| Molecular Weight | 230.410 g/mol |
| SMILES | C(=O)(SCCCC)CCCCCCCC |
| SPLASH | splash10-0a4l-8900000000-ab9a7c0c0442cadfb7cf |
| Source of Spectrum | J-59-5827-1 |
| Synonyms | S-butyl nonanethioate |
| Wiley ID | 1231878 |