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5-dodecyltetrahydro-1,3,5-triazine-2(1H)-thione
SpectraBase Compound ID FbuIjFRSaNh
InChI InChI=1S/C15H31N3S/c1-2-3-4-5-6-7-8-9-10-11-12-18-13-16-15(19)17-14-18/h2-14H2,1H3,(H2,16,17,19)
InChIKey TYYWCVCFXRCUIP-UHFFFAOYSA-N
Mol Weight 285.49 g/mol
Molecular Formula C15H31N3S
Exact Mass 285.223869 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GLFTxirnWwm
Name 5-Dodecyltetrahydro-1,3,5-triazine-2(1H)-thione
Comments Computed using HOSE algorithm
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Exact Mass 285.223869184 u
Formula C15H31N3S
InChI InChI=1S/C15H31N3S/c1-2-3-4-5-6-7-8-9-10-11-12-18-13-16-15(19)17-14-18/h2-14H2,1H3,(H2,16,17,19)
InChIKey TYYWCVCFXRCUIP-UHFFFAOYSA-N
Molecular Weight 285.494 g/mol
SMILES N1CN(CNC1=S)CCCCCCCCCCCC