| SpectraBase Compound ID | IICiCNaSJ9w |
|---|---|
| InChI | InChI=1S/C15H30O2/c1-5-9-11-13(7-3)15(16)17-14(8-4)12-10-6-2/h13-14H,5-12H2,1-4H3 |
| InChIKey | CRNWYIIRJDSUGO-UHFFFAOYSA-N |
| Mol Weight | 242.4 g/mol |
| Molecular Formula | C15H30O2 |
| Exact Mass | 242.22458 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3ELq4I01Fn8 |
|---|---|
| Name | 3-Heptyl 2-ethylhexanoate |
| Alternate Name(s) | 1-Ethylpentyl 2-ethylhexanoate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H30O2 |
| InChI | InChI=1S/C15H30O2/c1-5-9-11-13(7-3)15(16)17-14(8-4)12-10-6-2/h13-14H,5-12H2,1-4H3 |
| InChIKey | CRNWYIIRJDSUGO-UHFFFAOYSA-N |
| Molecular Weight | 242.403 g/mol |
| SMILES | C(OC(CC)CCCC)(=O)C(CC)CCCC |
| SPLASH | splash10-0a6u-9100000000-4138028cebd781a1b570 |
| Source of Spectrum | NW-1706-0-0 |
| Wiley ID | 1245485 |