![N-[3-(Indol-3-yl)propyl]-S-methyldithiocarbamate](/api/spectrum/35tdCywmfWt/structure.png?h=300&w=458 "N-[3-(Indol-3-yl)propyl]-S-methyldithiocarbamate")
| SpectraBase Compound ID | JerFaCbT84R |
|---|---|
| InChI | InChI=1S/C13H16N2S2/c1-17-13(16)14-8-4-5-10-9-15-12-7-3-2-6-11(10)12/h2-3,6-7,9,15H,4-5,8H2,1H3,(H,14,16) |
| InChIKey | NDDDWJQLRFNJSC-UHFFFAOYSA-N |
| Mol Weight | 264.4 g/mol |
| Molecular Formula | C13H16N2S2 |
| Exact Mass | 264.075491 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 35tdCywmfWt |
|---|---|
| Name | N-[3-(Indol-3-yl)propyl]-S-methyldithiocarbamate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 264.075490871 u |
| Formula | C13H16N2S2 |
| InChI | InChI=1S/C13H16N2S2/c1-17-13(16)14-8-4-5-10-9-15-12-7-3-2-6-11(10)12/h2-3,6-7,9,15H,4-5,8H2,1H3,(H,14,16) |
| InChIKey | NDDDWJQLRFNJSC-UHFFFAOYSA-N |
| SMILES | C=1NC2=C(C1CCCNC(=S)SC)C=CC=C2 |