| SpectraBase Compound ID | G7kLpIjLVPe |
|---|---|
| InChI | InChI=1S/C16H23NO3S/c1-3-4-10-15(21-13(2)18)11-17-16(19)20-12-14-8-6-5-7-9-14/h5-9,15H,3-4,10-12H2,1-2H3,(H,17,19) |
| InChIKey | KVZFYIZFXTVLEV-UHFFFAOYSA-N |
| Mol Weight | 309.42 g/mol |
| Molecular Formula | C16H23NO3S |
| Exact Mass | 309.139865 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DHKvWzPeUx4 |
|---|---|
| Name | 1-(Benzyloxycarbonyl)aminomethylpentyl thioacetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 309.139864776 u |
| Formula | C16H23NO3S |
| InChI | InChI=1S/C16H23NO3S/c1-3-4-10-15(21-13(2)18)11-17-16(19)20-12-14-8-6-5-7-9-14/h5-9,15H,3-4,10-12H2,1-2H3,(H,17,19) |
| InChIKey | KVZFYIZFXTVLEV-UHFFFAOYSA-N |
| Molecular Weight | 309.424 g/mol |
| SMILES | C(NCC(SC(=O)C)CCCC)(=O)OCC=1C=CC=CC1 |