| SpectraBase Compound ID | JmTYa2OCaXo |
|---|---|
| InChI | InChI=1S/C12H12O2/c1-9(13)12(10(2)14)8-11-6-4-3-5-7-11/h3-8H,1-2H3 |
| InChIKey | NYRGMNMVISROGJ-UHFFFAOYSA-N |
| Mol Weight | 188.23 g/mol |
| Molecular Formula | C12H12O2 |
| Exact Mass | 188.08373 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 4a2eqXuMSG |
|---|---|
| Name | 3-Benzylidenepentane-2,4-dione |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H12O2 |
| InChI | InChI=1S/C12H12O2/c1-9(13)12(10(2)14)8-11-6-4-3-5-7-11/h3-8H,1-2H3 |
| InChIKey | NYRGMNMVISROGJ-UHFFFAOYSA-N |
| Literature Reference DOI | 10.1002/hlca.201200004 |
| Molecular Weight | 188.226 g/mol |
| SMILES | CC(C(C(C)=O)=Cc1ccccc1)=O |
| SPLASH | splash10-0019-0900000000-6d255e9265b193f6c6da |
| Source of Spectrum | H-95-1416-11f |
| Wiley ID | 1784353 |