| SpectraBase Compound ID | hDT831IesM |
|---|---|
| InChI | InChI=1S/C13H17NO4/c1-16-11-5-4-10(8-12(11)17-2)9-14-7-6-13(15)18-3/h4-8,14H,9H2,1-3H3/b7-6+ |
| InChIKey | HJHIIMPAYLDGHL-VOTSOKGWSA-N |
| Mol Weight | 251.28 g/mol |
| Molecular Formula | C13H17NO4 |
| Exact Mass | 251.115758 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Dghi5zXzcrr |
|---|---|
| Name | (E)-3-(Veratrylamino)acrylic acid methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 251.115758027 u |
| Formula | C13H17NO4 |
| InChI | InChI=1S/C13H17NO4/c1-16-11-5-4-10(8-12(11)17-2)9-14-7-6-13(15)18-3/h4-8,14H,9H2,1-3H3/b7-6+ |
| InChIKey | HJHIIMPAYLDGHL-VOTSOKGWSA-N |
| Molecular Weight | 251.282 g/mol |
| SMILES | C(\C=C\NCC=1C=C(C(=CC1)OC)OC)(=O)OC |