![2,4-Pentanedione, 3-[bis(dimethylamino)methylene]-](/api/spectrum/AM5wEWYJTF1/structure.png?h=300&w=458 "2,4-Pentanedione, 3-[bis(dimethylamino)methylene]-")
| SpectraBase Compound ID | JlCtxgHW9YS |
|---|---|
| InChI | InChI=1S/C10H18N2O2/c1-7(13)9(8(2)14)10(11(3)4)12(5)6/h1-6H3 |
| InChIKey | DPTUPVPDYSBZNC-UHFFFAOYSA-N |
| Mol Weight | 198.27 g/mol |
| Molecular Formula | C10H18N2O2 |
| Exact Mass | 198.136828 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | AM5wEWYJTF1 |
|---|---|
| Name | 2,4-Pentanedione, 3-[bis(dimethylamino)methylene]- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 198.136827826 u |
| Formula | C10H18N2O2 |
| InChI | InChI=1S/C10H18N2O2/c1-7(13)9(8(2)14)10(11(3)4)12(5)6/h1-6H3 |
| InChIKey | DPTUPVPDYSBZNC-UHFFFAOYSA-N |
| Molecular Weight | 198.266 g/mol |
| SMILES | C(C(=C(N(C)C)N(C)C)C(C)=O)(C)=O |
| Spectrum/Structure Validation Score (Raman) | 0.975509 |