![Butyl 4-[(methoxycarbonyl)amino]benzoate](/api/spectrum/L4TgMGav2MT/structure.png?h=300&w=458 "Butyl 4-[(methoxycarbonyl)amino]benzoate")
| SpectraBase Compound ID | 2Uj27K88qYc |
|---|---|
| InChI | InChI=1S/C13H17NO4/c1-3-4-9-18-12(15)10-5-7-11(8-6-10)14-13(16)17-2/h5-8H,3-4,9H2,1-2H3,(H,14,16) |
| InChIKey | YVGSVUDCPCRDNS-UHFFFAOYSA-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 | L4TgMGav2MT |
|---|---|
| Name | Butyl 4-[(methoxycarbonyl)amino]benzoate |
| 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/c1-3-4-9-18-12(15)10-5-7-11(8-6-10)14-13(16)17-2/h5-8H,3-4,9H2,1-2H3,(H,14,16) |
| InChIKey | YVGSVUDCPCRDNS-UHFFFAOYSA-N |
| Molecular Weight | 251.282 g/mol |
| SMILES | N(C(=O)OC)C=1C=CC(C(=O)OCCCC)=CC1 |