| SpectraBase Compound ID | H3CA2YFpFjj |
|---|---|
| InChI | InChI=1S/C9H19NS2.Na/c1-3-5-7-10(9(11)12)8-6-4-2;/h3-8H2,1-2H3,(H,11,12);/q;+1/p-1 |
| InChIKey | HUMLQUKVJARKRN-UHFFFAOYSA-M |
| Mol Weight | 227.36 g/mol |
| Molecular Formula | C9H18NNaS2 |
| Exact Mass | 227.077836 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JUlcUR3Qwql |
|---|---|
| Name | Sodium di-N-butyl dithiocarbamate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 227.077836212 u |
| Formula | C9H18NNaS2 |
| InChI | InChI=1S/C9H19NS2.Na/c1-3-5-7-10(9(11)12)8-6-4-2;/h3-8H2,1-2H3,(H,11,12);/q;+1/p-1 |
| InChIKey | HUMLQUKVJARKRN-UHFFFAOYSA-M |
| Molecular Weight | 227.360 g/mol |
| SMILES | CCCCN(C(S[Na])=S)CCCC |