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3-Benzyl-1-cyclohexyl-1-ethyl-thiourea
SpectraBase Compound ID 5BabXo7culC
InChI InChI=1S/C16H24N2S/c1-2-18(15-11-7-4-8-12-15)16(19)17-13-14-9-5-3-6-10-14/h3,5-6,9-10,15H,2,4,7-8,11-13H2,1H3,(H,17,19)
InChIKey FUDHHEKFZIQTPU-UHFFFAOYSA-N
Mol Weight 276.44 g/mol
Molecular Formula C16H24N2S
Exact Mass 276.16602 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FTxzEXt3k5q
Name 3-Benzyl-1-cyclohexyl-1-ethyl-thiourea
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 276.166019955 u
Formula C16H24N2S
InChI InChI=1S/C16H24N2S/c1-2-18(15-11-7-4-8-12-15)16(19)17-13-14-9-5-3-6-10-14/h3,5-6,9-10,15H,2,4,7-8,11-13H2,1H3,(H,17,19)
InChIKey FUDHHEKFZIQTPU-UHFFFAOYSA-N
Molecular Weight 276.442 g/mol
SMILES C(N(C1CCCCC1)CC)(NCC1=CC=CC=C1)=S