![Acetophenone 4-[1-methyl-4-diethylaminobutyl]thiosemicarbazone](/api/spectrum/LjuEmwwXjFc/structure.png?h=300&w=458 "Acetophenone 4-[1-methyl-4-diethylaminobutyl]thiosemicarbazone")
| SpectraBase Compound ID | AarsFpeXpAP |
|---|---|
| InChI | InChI=1S/C18H30N4S/c1-5-22(6-2)14-10-11-15(3)19-18(23)21-20-16(4)17-12-8-7-9-13-17/h7-9,12-13,15H,5-6,10-11,14H2,1-4H3,(H2,19,21,23)/b20-16- |
| InChIKey | TWONHVIRGMLHLO-SILNSSARSA-N |
| Mol Weight | 334.53 g/mol |
| Molecular Formula | C18H30N4S |
| Exact Mass | 334.219118 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LjuEmwwXjFc |
|---|---|
| Name | Acetophenone 4-[1-methyl-4-diethylaminobutyl]thiosemicarbazone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 334.219118156 u |
| Formula | C18H30N4S |
| InChI | InChI=1S/C18H30N4S/c1-5-22(6-2)14-10-11-15(3)19-18(23)21-20-16(4)17-12-8-7-9-13-17/h7-9,12-13,15H,5-6,10-11,14H2,1-4H3,(H2,19,21,23)/b20-16- |
| InChIKey | TWONHVIRGMLHLO-SILNSSARSA-N |
| Molecular Weight | 334.526 g/mol |
| SMILES | C1(\C(=N/NC(=S)NC(C)CCCN(CC)CC)C)=CC=CC=C1 |