| SpectraBase Compound ID | 3MnXeB93IUP |
|---|---|
| InChI | InChI=1S/C15H23NO4/c1-10(2)20-15-13(18-4)8-12(9-14(15)19-5)6-7-16-11(3)17/h8-10H,6-7H2,1-5H3,(H,16,17) |
| InChIKey | HGBREBCNUYPAIW-UHFFFAOYSA-N |
| Mol Weight | 281.35 g/mol |
| Molecular Formula | C15H23NO4 |
| Exact Mass | 281.162708 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | CO6t6wIlAIH |
|---|---|
| Name | ip ac |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 281.162708221 u |
| Formula | C15H23NO4 |
| InChI | InChI=1S/C15H23NO4/c1-10(2)20-15-13(18-4)8-12(9-14(15)19-5)6-7-16-11(3)17/h8-10H,6-7H2,1-5H3,(H,16,17) |
| InChIKey | HGBREBCNUYPAIW-UHFFFAOYSA-N |
| Molecular Weight | 281.352 g/mol |
| SMILES | C1(=C(C=C(C=C1OC)CCNC(=O)C)OC)OC(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.964483 |