| SpectraBase Compound ID | 6YehhyT1Boe |
|---|---|
| InChI | InChI=1S/C9H11NO3/c1-9(11,7-10(12)13)8-5-3-2-4-6-8/h2-6,11H,7H2,1H3 |
| InChIKey | YZUXCMFXLNWAGB-UHFFFAOYSA-N |
| Mol Weight | 181.19 g/mol |
| Molecular Formula | C9H11NO3 |
| Exact Mass | 181.073893 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 1LQ5GQ4utIA |
|---|---|
| Name | 1-Nitro-2-phenylpropan-2-ol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H11NO3 |
| InChI | InChI=1S/C9H11NO3/c1-9(11,7-10(12)13)8-5-3-2-4-6-8/h2-6,11H,7H2,1H3 |
| InChIKey | YZUXCMFXLNWAGB-UHFFFAOYSA-N |
| Literature Reference DOI | 10.1002/cssc.201500188 |
| Molecular Weight | 181.191 g/mol |
| SMILES | OC(C[N+]([O-])=O)(c1ccccc1)C |
| SPLASH | splash10-0a6r-5900000000-15952f02c965ce679736 |
| Source of Spectrum | CSC-8-3173-2b |
| Wiley ID | 1799317 |