| SpectraBase Compound ID | 1tIzNRLUHIn |
|---|---|
| InChI | InChI=1S/C9H11NO3/c1-13-6-5-8-3-2-4-9(7-8)10(11)12/h2-4,7H,5-6H2,1H3 |
| InChIKey | RSPHSWMLOQVDSX-UHFFFAOYSA-N |
| Mol Weight | 181.19 g/mol |
| Molecular Formula | C9H11NO3 |
| Exact Mass | 181.073893 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7VpidZheljX |
|---|---|
| Name | 3-Nitrophenethyl alcohol, methyl ether |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 181.073893215 u |
| Formula | C9H11NO3 |
| InChI | InChI=1S/C9H11NO3/c1-13-6-5-8-3-2-4-9(7-8)10(11)12/h2-4,7H,5-6H2,1H3 |
| InChIKey | RSPHSWMLOQVDSX-UHFFFAOYSA-N |
| Molecular Weight | 181.191 g/mol |
| SMILES | C1(=CC(=CC=C1)N(=O)=O)CCOC |