| SpectraBase Compound ID | JMg5mr2bumG |
|---|---|
| InChI | InChI=1S/C12H14O2/c1-10(13)8-11(2)14-9-12-6-4-3-5-7-12/h3-8H,9H2,1-2H3/b11-8+ |
| InChIKey | LYGJVBLUTFTKRK-DHZHZOJOSA-N |
| Mol Weight | 190.24 g/mol |
| Molecular Formula | C12H14O2 |
| Exact Mass | 190.09938 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 1My16lIg2q4 |
|---|---|
| Name | 3-Penten-2-one, 4-(phenylmethoxy)- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 190.099379689 u |
| Formula | C12H14O2 |
| InChI | InChI=1S/C12H14O2/c1-10(13)8-11(2)14-9-12-6-4-3-5-7-12/h3-8H,9H2,1-2H3/b11-8+ |
| InChIKey | LYGJVBLUTFTKRK-DHZHZOJOSA-N |
| Molecular Weight | 190.242 g/mol |
| SMILES | C(O\C(=C\C(=O)C)C)C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.800942 |