| SpectraBase Compound ID | F6EaqyJaW9C |
|---|---|
| InChI | InChI=1S/C11H15NO4/c1-3-6-16-8-9-4-5-11(15-2)10(7-9)12(13)14/h4-5,7H,3,6,8H2,1-2H3 |
| InChIKey | GMJJCYPRAWUEQT-UHFFFAOYSA-N |
| Mol Weight | 225.24 g/mol |
| Molecular Formula | C11H15NO4 |
| Exact Mass | 225.100108 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3CNI22RMO9i |
|---|---|
| Name | 4-Methoxy-3-nitrobenzyl alcohol, N-propyl ether |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 225.100107963 u |
| Formula | C11H15NO4 |
| InChI | InChI=1S/C11H15NO4/c1-3-6-16-8-9-4-5-11(15-2)10(7-9)12(13)14/h4-5,7H,3,6,8H2,1-2H3 |
| InChIKey | GMJJCYPRAWUEQT-UHFFFAOYSA-N |
| Molecular Weight | 225.244 g/mol |
| SMILES | C1(=CC(=C(C=C1)OC)N(=O)=O)COCCC |