![(rs)-[4-(Benzyloxycarbonyl)amino]butan-2,4-diol](/api/spectrum/CQpvHOf6p4C/structure.png?h=300&w=458 "(rs)-[4-(Benzyloxycarbonyl)amino]butan-2,4-diol")
| SpectraBase Compound ID | 9wSynpu2iJp |
|---|---|
| InChI | InChI=1S/C12H17NO4/c14-7-6-11(15)8-13-12(16)17-9-10-4-2-1-3-5-10/h1-5,11,14-15H,6-9H2,(H,13,16) |
| InChIKey | RKCMHVFAZKDZGA-UHFFFAOYSA-N |
| Mol Weight | 239.27 g/mol |
| Molecular Formula | C12H17NO4 |
| Exact Mass | 239.115758 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CQpvHOf6p4C |
|---|---|
| Name | (rs)-[4-(Benzyloxycarbonyl)amino]butan-2,4-diol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 239.115758027 u |
| Formula | C12H17NO4 |
| InChI | InChI=1S/C12H17NO4/c14-7-6-11(15)8-13-12(16)17-9-10-4-2-1-3-5-10/h1-5,11,14-15H,6-9H2,(H,13,16) |
| InChIKey | RKCMHVFAZKDZGA-UHFFFAOYSA-N |
| Molecular Weight | 239.271 g/mol |
| SMILES | C(NCC(CCO)O)(=O)OCC=1C=CC=CC1 |