| SpectraBase Compound ID | AyoYRxncx6Y |
|---|---|
| InChI | InChI=1S/C8H16O2/c1-3-5-6-7(4-2)8(9)10/h7H,3-6H2,1-2H3,(H,9,10) |
| InChIKey | OBETXYAYXDNJHR-UHFFFAOYSA-N |
| Mol Weight | 144.21 g/mol |
| Molecular Formula | C8H16O2 |
| Exact Mass | 144.11503 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | GUOJJgW06eu |
|---|---|
| Name | 2-Ethylhexanoic acid |
| CAS Registry Number | 149-57-5 |
| Classification | Chemical |
| Copyright | Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass | 144.115029753 u |
| Formula | C8H16O2 |
| InChI | InChI=1S/C8H16O2/c1-3-5-6-7(4-2)8(9)10/h7H,3-6H2,1-2H3,(H,9,10) |
| InChIKey | OBETXYAYXDNJHR-UHFFFAOYSA-N |
| Ionization Type | Electron Ionization (EI) |
| Molecular Weight | 144.214 g/mol |
| Nominal Mass | 144 u |
| Quality | 807 |
| Retention Index | 990 |
| SMILES | OC(C(CCCC)CC)=O |
| SPLASH | splash10-0079-9100000000-b80300702a41641c7fde |
| Source of Spectrum | DigiLab GmbH (C) 2024 |
| Synonyms | 2-ethylhexanoic acid |
| Technique | GC/MS |
| Wiley ID | DD2024_005550 |