| SpectraBase Compound ID | 2B7kF3mETcN |
|---|---|
| InChI | InChI=1S/C4H7NOS/c1-6-3-2-5-4-7/h2-3H2,1H3 |
| InChIKey | HTSAVXAFEVUJQE-UHFFFAOYSA-N |
| Mol Weight | 117.17 g/mol |
| Molecular Formula | C4H7NOS |
| Exact Mass | 117.024835 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EfKm7jZ0H5h |
|---|---|
| Name | 2-Methoxyethyl isothiocyanate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 117.024835022 u |
| Formula | C4H7NOS |
| InChI | InChI=1S/C4H7NOS/c1-6-3-2-5-4-7/h2-3H2,1H3 |
| InChIKey | HTSAVXAFEVUJQE-UHFFFAOYSA-N |
| Molecular Weight | 117.166 g/mol |
| SMILES | C(OC)CN=C=S |