| SpectraBase Compound ID | BTFF8VlotAr |
|---|---|
| InChI | InChI=1S/C13H17NO3/c1-8(2)12(14-3)13(15)9-4-5-10-11(6-9)17-7-16-10/h4-6,8,12,14H,7H2,1-3H3 |
| InChIKey | IUSHOQXYDDUICV-UHFFFAOYSA-N |
| Mol Weight | 235.28 g/mol |
| Molecular Formula | C13H17NO3 |
| Exact Mass | 235.120843 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8ewDjgQyN2U |
|---|---|
| Name | nan |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 235.120843408 u |
| Formula | C13H17NO3 |
| InChI | InChI=1S/C13H17NO3/c1-8(2)12(14-3)13(15)9-4-5-10-11(6-9)17-7-16-10/h4-6,8,12,14H,7H2,1-3H3 |
| InChIKey | IUSHOQXYDDUICV-UHFFFAOYSA-N |
| Molecular Weight | 235.283 g/mol |
| SMILES | N(C(C(C1=CC=C2OCOC2=C1)=O)C(C)C)C |