| SpectraBase Compound ID | Fcxjzeognsj |
|---|---|
| InChI | InChI=1S/C13H14O2/c1-2-3-4-8-11-15-13(14)12-9-6-5-7-10-12/h1,5-7,9-10H,3-4,8,11H2 |
| InChIKey | LTPIWICRXZBHLV-UHFFFAOYSA-N |
| Mol Weight | 202.25 g/mol |
| Molecular Formula | C13H14O2 |
| Exact Mass | 202.09938 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 55fVsIMWKSv |
|---|---|
| Name | Hex-5-ynyl benzoate |
| Alternate Name(s) | benzoic acid hex-5-ynyl ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H14O2 |
| InChI | InChI=1S/C13H14O2/c1-2-3-4-8-11-15-13(14)12-9-6-5-7-10-12/h1,5-7,9-10H,3-4,8,11H2 |
| InChIKey | LTPIWICRXZBHLV-UHFFFAOYSA-N |
| Molecular Weight | 202.253 g/mol |
| SMILES | C(c1ccccc1)(=O)OCCCCC#C |
| SPLASH | splash10-0zi0-7980000000-61648b7ec00ba33ad3ea |
| Source of Spectrum | K1-2004-3451-1 |
| Wiley ID | 1561338 |