| SpectraBase Compound ID | CodRnqT7FWa |
|---|---|
| InChI | InChI=1S/C9H17NO3/c1-7(11)10-6-5-8(12)13-9(2,3)4/h5-6H2,1-4H3,(H,10,11) |
| InChIKey | INIIDHXJMONHDV-UHFFFAOYSA-N |
| Mol Weight | 187.24 g/mol |
| Molecular Formula | C9H17NO3 |
| Exact Mass | 187.120843 g/mol |
Vapor Phase (Gas) Infrared Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | IUXkWyVHZbr |
|---|---|
| Name | H-beta-ala-Otbu, ac |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 187.120843408 u |
| Formula | C9H17NO3 |
| InChI | InChI=1S/C9H17NO3/c1-7(11)10-6-5-8(12)13-9(2,3)4/h5-6H2,1-4H3,(H,10,11) |
| InChIKey | INIIDHXJMONHDV-UHFFFAOYSA-N |
| Molecular Weight | 187.239 g/mol |
| SMILES | C(CCNC(C)=O)(=O)OC(C)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.814952 |